A0A087YAF0_POEFO Loading...

F-box protein 30a

AlphaFold DB , UniProt , Accession A0A087YAF0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 710 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.6	Very low	83.6	Confident	236 Å²	236	100.4 Å²	100.4	100%	1.163	50%	0.502	S	S	*	.				0	118.9	0	-62.7	171.2	-163.5	0	0	106.3
2	E	59.6	Low	84.3	Confident	191 Å²	191	105.5 Å²	105.5	89%	0.893	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-70.6	132	171.5	-67.9	-176.2	146.1	0	0	108.4
3	N	75	Confident	85	Confident	143 Å²	143	104.5 Å²	104.5	77%	0.765	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-68.4	141	-175.9	-70.5	-50.3	0	0	0	110.6	H5	N3-H5 PolarHBondContact O-N 3.27Å
4	L	85.3	Confident	85.4	Confident	60 Å²	60	108.4 Å²	108.4	31%	0.314	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-54.3	123.9	173.1	-74.8	163.2	0	0	0	110.4	L9 C42 K43 E46	L4-L9 HydrophobicContact CB-CD1 4.28Å; L4-L9 HydrophobicContact CD1-CD1 3.81Å; L4-C42 HydrophobicContact CD2-CB 4.43Å; L4-C42 VanDerWaalsContact CD2-O 3.29Å; L4-C42 WeakPolarHBondContact CD2-O 3.35Å; L4-K43 HydrophobicContact CD2-CG 4.11Å; L4-E46 VanDerWaalsContact CD1-OE1 3.28Å; L4-E46 WeakPolarHBondContact CD1-OE1 3.14Å
5	H	93.1	Very high	86	Confident	37 Å²	37	115.1 Å²	115.1	17%	0.171	55%	0.55	C	S	.	.	P	Polyproline II helix	trans	-61.4	143.4	-178.5	-59.9	123.2	0	0	0	112.1	N3 H7 C8 L9 G23 V24	N3-H5 PolarHBondContact O-N 3.27Å; H5-H7 VanDerWaalsContact C-N 3.3Å; H5-H7 PolarHBondContact O-N 3.31Å; H5-C8 HydrophobicContact CB-CB 3.99Å; H5-C8 PolarHBondContact O-N 3.07Å; H5-L9 PolarHBondContact O-N 2.66Å; H5-G23 VanDerWaalsContact CD2-C 3.48Å; H5-V24 WeakPolarHBondContact CB-O 3.47Å
6	P	93.7	Very high	86.5	Confident	84 Å²	84	109.1 Å²	109.1	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-57	-35.4	-175.4	-27.6	35.4	0	0	0	115.1	G23	P6-G23 WeakPolarHBondContact CD-O 3.35Å
7	H	94.1	Very high	86.9	Confident	64 Å²	64	113 Å²	113	30%	0.296	54%	0.543	S	S	.	.	H	α-helix	trans	-69.2	-54	170.6	173	82.7	0	0	0	110.8	H5 L9 K10 C11 C16 V24 H40	H5-H7 VanDerWaalsContact C-N 3.3Å; H5-H7 PolarHBondContact O-N 3.31Å; H7-L9 VanDerWaalsContact C-N 3.31Å; H7-L9 PolarHBondContact O-N 3.08Å; H7-K10 PolarHBondContact O-N 3.13Å; H7-K10 VanDerWaalsContact O-N 3.08Å; H7-C11 WeakPolarHBondContact O-CB 3.38Å; H7-C11 PolarHBondContact O-N 2.98Å; H7-C16 PolarHBondContact NE2-SG 3.3Å; H7-V24 WeakPolarHBondContact CB-O 3.47Å; H7-V24 PolarHBondContact N-O 3.46Å; H7-H40 AromaticContact CD2-CE1 3.91Å; H7-H40 AromaticContact CD2-NE2 3.67Å; H7-H40 AromaticContact NE2-CE1 3.89Å; H7-H40 AromaticContact NE2-NE2 3.48Å; H7-H40 PolarHBondContact NE2-NE2 2.87Å
8	C	94.4	Very high	87.2	Confident	0 Å²	0	108.9 Å²	108.9	0%	0	53%	0.531	C	S	.	.	H	α-helix	trans	-57.9	-43.4	-171.9	-62.9	0	0	0	0	111.7	H5 K10 C11 H40 C42 K43	H5-C8 HydrophobicContact CB-CB 3.99Å; H5-C8 PolarHBondContact O-N 3.07Å; C8-K10 PolarHBondContact O-N 3.19Å; C8-C11 PolarHBondContact O-N 2.97Å; C8-H40 HydrophobicContact CB-CB 4.01Å; C8-C42 WeakPolarHBondContact CB-SG 3.36Å; C8-K43 WeakPolarHBondContact O-CE 3.46Å; C8-K43 PolarHBondContact O-NZ 2.94Å
9	L	92.4	Very high	87.5	Confident	96 Å²	96	112.6 Å²	112.6	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-48.6	-46.9	176.7	-175.6	67.9	0	0	0	111.8	L4 H5 H7 K43	L4-L9 HydrophobicContact CB-CD1 4.28Å; L4-L9 HydrophobicContact CD1-CD1 3.81Å; H5-L9 PolarHBondContact O-N 2.66Å; H7-L9 VanDerWaalsContact C-N 3.31Å; H7-L9 PolarHBondContact O-N 3.08Å; L9-K43 PolarHBondContact O-NZ 3.03Å
10	K	92.8	Very high	87.7	Confident	177 Å²	177	110.4 Å²	110.4	77%	0.77	54%	0.539	S	S	*	.	H	α-helix	trans	-86	-14	-179	-60.3	176	-176.1	176.1	0	113.8	H7 C8	H7-K10 PolarHBondContact O-N 3.13Å; H7-K10 VanDerWaalsContact O-N 3.08Å; C8-K10 PolarHBondContact O-N 3.19Å
11	C	93.3	Very high	87.9	Confident	16 Å²	16	110.4 Å²	110.4	11%	0.108	54%	0.538	C	S	.	.			trans	-80.2	121.1	-177.9	-173.4	0	0	0	0	111.9	H7 C8 C16 H40 K43	H7-C11 WeakPolarHBondContact O-CB 3.38Å; H7-C11 PolarHBondContact O-N 2.98Å; C8-C11 PolarHBondContact O-N 2.97Å; C11-C16 VanDerWaalsContact SG-SG 3.69Å; C11-H40 PolarHBondContact SG-NE2 2.94Å; C11-K43 PolarHBondContact O-NZ 3Å
12	I	92.8	Very high	90	Very high	162 Å²	162	105.4 Å²	105.4	83%	0.831	52%	0.523	S	S	*	.			trans	-112.7	2.2	172.3	62.6	170.4	0	0	0	112.8	R14	I12-R14 PolarHBondContact O-N 3.46Å
13	N	93.3	Very high	91.3	Very high	93 Å²	93	98.6 Å²	98.6	50%	0.497	50%	0.504	S	S	.	.			trans	-85.5	115.7	-173.8	-174.3	-3.6	0	0	0	111.5	R15 C16	N13-R15 PolarHBondContact O-N 3.37Å; N13-R15 VanDerWaalsContact O-N 3.16Å; N13-R15 PolarHBondContact OD1-N 3.41Å; N13-C16 HydrophobicContact CB-CB 4.46Å; N13-C16 PolarHBondContact O-N 3.06Å
14	R	90.3	Very high	92.1	Very high	158 Å²	158	94.7 Å²	94.7	60%	0.596	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-14	177	-65.6	172.6	67.2	-164.3	4.6	114.3	I12 G36 V38	I12-R14 PolarHBondContact O-N 3.46Å; R14-G36 PolarHBondContact NH2-O 3.18Å; R14-V38 WeakPolarHBondContact O-CG1 3.48Å
15	R	93.6	Very high	92.5	Very high	210 Å²	210	92.1 Å²	92.1	79%	0.792	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	47.7	174	-61.1	-176.7	-177	178.8	0.4	109.8	N13 M17	N13-R15 PolarHBondContact O-N 3.37Å; N13-R15 VanDerWaalsContact O-N 3.16Å; N13-R15 PolarHBondContact OD1-N 3.41Å; R15-M17 PolarHBondContact O-N 3.01Å
16	C	94.8	Very high	92.5	Very high	19 Å²	19	91.1 Å²	91.1	13%	0.128	47%	0.469	C	S	.	.			trans	-58.5	135.1	172.8	-166.5	0	0	0	0	111	H7 C11 N13 A18 L28	H7-C16 PolarHBondContact NE2-SG 3.3Å; C11-C16 VanDerWaalsContact SG-SG 3.69Å; N13-C16 HydrophobicContact CB-CB 4.46Å; N13-C16 PolarHBondContact O-N 3.06Å; C16-A18 VanDerWaalsContact SG-CB 3.6Å; C16-A18 PolarHBondContact SG-N 3Å; C16-L28 HydrophobicContact CB-CD1 4.07Å; C16-L28 HydrophobicContact CB-CD2 4.27Å; C16-L28 HydrophobicContact CB-CG 4.46Å; C16-L28 WeakPolarHBondContact O-CD1 3.46Å
17	M	94	Very high	92.6	Very high	175 Å²	175	91.9 Å²	91.9	86%	0.862	47%	0.469	S	S	*	.			trans	-109.3	13.2	178.2	-59.9	-63.4	-65.8	0	0	112.1	R15	R15-M17 PolarHBondContact O-N 3.01Å
18	A	91.9	Very high	92.6	Very high	39 Å²	39	91.6 Å²	91.6	32%	0.322	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-64.7	135	172.9	0	0	0	0	0	109.6	C16	C16-A18 VanDerWaalsContact SG-CB 3.6Å; C16-A18 PolarHBondContact SG-N 3Å
19	K	91.6	Very high	92.7	Very high	179 Å²	179	94.1 Å²	94.1	78%	0.778	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-73	134.2	177.3	-68	-176	177.6	-178	0	109.6	E21 S25	K19-E21 PolarHBondContact O-N 3.37Å; K19-S25 PolarHBondContact O-OG 3.42Å
20	P	92.6	Very high	92.9	Very high	68 Å²	68	91.7 Å²	91.7	44%	0.442	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-54.1	130.2	169.8	-21.7	31.2	0	0	0	110.2	D27	P20-D27 WeakPolarHBondContact CG-OD1 3.25Å
21	E	92.3	Very high	93	Very high	111 Å²	111	83.7 Å²	83.7	52%	0.519	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-146.7	120.6	-178.2	176.7	175	-154.5	0	0	108.2	K19 G23 V24 S25	K19-E21 PolarHBondContact O-N 3.37Å; E21-G23 PolarHBondContact O-N 3.48Å; E21-V24 HydrophobicContact CB-CB 4.08Å; E21-V24 HydrophobicContact CG-CB 3.99Å; E21-V24 HydrophobicContact CG-CG2 4.07Å; E21-V24 PolarHBondContact O-N 2.79Å; E21-S25 CarbonylContact C-O 3.54Å; E21-S25 PolarHBondContact N-O 3.1Å; E21-S25 PolarHBondContact O-N 3.04Å
22	P	88.6	Confident	93.2	Very high	131 Å²	131	87.4 Å²	87.4	85%	0.851	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	123.3	-174.8	-29.1	35.7	0	0	0	112.9	V24	P22-V24 VanDerWaalsContact C-N 3.25Å; P22-V24 PolarHBondContact O-N 3.13Å
23	G	87.8	Confident	93.4	Very high	48 Å²	48	83 Å²	83	50%	0.495	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-11.5	-178.1	0	0	0	0	0	115.6	H5 P6 E21	H5-G23 VanDerWaalsContact CD2-C 3.48Å; P6-G23 WeakPolarHBondContact CD-O 3.35Å; E21-G23 PolarHBondContact O-N 3.48Å
24	V	91	Very high	93.5	Very high	62 Å²	62	84.6 Å²	84.6	38%	0.376	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-44.7	-176.8	-177.8	0	0	0	0	112.6	H5 H7 E21 P22	H5-V24 WeakPolarHBondContact CB-O 3.47Å; H7-V24 WeakPolarHBondContact CB-O 3.47Å; H7-V24 PolarHBondContact N-O 3.46Å; E21-V24 HydrophobicContact CB-CB 4.08Å; E21-V24 HydrophobicContact CG-CB 3.99Å; E21-V24 HydrophobicContact CG-CG2 4.07Å; E21-V24 PolarHBondContact O-N 2.79Å; P22-V24 VanDerWaalsContact C-N 3.25Å; P22-V24 PolarHBondContact O-N 3.13Å
25	S	93.9	Very high	93.8	Very high	6 Å²	6	78.8 Å²	78.8	4%	0.042	45%	0.446	C	S	.	.	B	Isolated β-bridge	trans	-157.8	163	174.2	96.5	0	0	0	0	112.6	K19 E21	K19-S25 PolarHBondContact O-OG 3.42Å; E21-S25 CarbonylContact C-O 3.54Å; E21-S25 PolarHBondContact N-O 3.1Å; E21-S25 PolarHBondContact O-N 3.04Å
26	C	94.3	Very high	93.8	Very high	15 Å²	15	71 Å²	71	10%	0.101	43%	0.432	C	S	.	.			trans	-135.4	171.6	179.5	61	0	0	0	0	112.5	H40 S41 C42	C26-H40 PolarHBondContact O-ND1 3.26Å; C26-S41 PolarHBondContact SG-OG 2.91Å; C26-C42 VanDerWaalsContact SG-SG 3.66Å
27	D	94.7	Very high	93.9	Very high	101 Å²	101	71.2 Å²	71.2	54%	0.54	44%	0.435	S	S	.	.			trans	-58.2	150	-178.9	-66.1	-76.3	0	0	0	114.4	P20 H40 S41	P20-D27 WeakPolarHBondContact CG-OD1 3.25Å; D27-H40 CarbonylContact O-C 3.51Å; D27-H40 WeakPolarHBondContact O-CA 3.13Å; D27-S41 PolarHBondContact O-N 3.09Å
28	L	95.1	Very high	94	Very high	58 Å²	58	65.4 Å²	65.4	30%	0.304	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.9	166.1	-70.1	179.5	0	0	0	110.1	C16 V38 F39	C16-L28 HydrophobicContact CB-CD1 4.07Å; C16-L28 HydrophobicContact CB-CD2 4.27Å; C16-L28 HydrophobicContact CB-CG 4.46Å; C16-L28 WeakPolarHBondContact O-CD1 3.46Å; L28-V38 HydrophobicContact CB-CG1 4.12Å; L28-V38 HydrophobicContact CD1-CG1 4.42Å; L28-F39 WeakPolarHBondContact CA-O 3.34Å
29	V	95.5	Very high	94.1	Very high	52 Å²	52	64.6 Å²	64.6	32%	0.315	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	150	173.2	-60.5	0	0	0	0	110.2	V38 F39	V29-V38 WeakPolarHBondContact O-CA 3.23Å; V29-F39 HydrophobicContact CG2-CD2 4.06Å; V29-F39 HydrophobicContact CG2-CE2 3.8Å; V29-F39 PolarHBondContact N-O 3.24Å; V29-F39 PolarHBondContact O-N 2.81Å
30	G	96	Very high	94.3	Very high	45 Å²	45	56.3 Å²	56.3	46%	0.464	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	155.4	164.8	0	0	0	0	0	110.8	P32	G30-P32 WeakPolarHBondContact O-CD 3.33Å
31	C	96.6	Very high	94.4	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.061	36%	0.359	C	S	.	.			trans	-58.2	127.5	169.9	-178.6	0	0	0	0	110.9	L33 V34 C35 A37 F39 H47	C31-L33 PolarHBondContact O-N 3.05Å; C31-L33 VanDerWaalsContact O-N 3.14Å; C31-L33 PolarHBondContact SG-N 2.66Å; C31-L33 VanDerWaalsContact SG-N 3.43Å; C31-V34 WeakPolarHBondContact O-CA 3.31Å; C31-V34 PolarHBondContact O-N 3.09Å; C31-C35 WeakPolarHBondContact CB-SG 3.42Å; C31-A37 HydrophobicContact CB-CB 4.42Å; C31-A37 PolarHBondContact N-O 3.35Å; C31-F39 HydrophobicContact CB-CE1 3.97Å; C31-F39 HydrophobicContact CB-CZ 4.2Å; C31-H47 PolarHBondContact SG-NE2 3.42Å
32	P	96.4	Very high	94.5	Very high	94 Å²	94	52.1 Å²	52.1	61%	0.61	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-26.8	176.1	-26.3	35.3	0	0	0	113.8	G30 V34 L44	G30-P32 WeakPolarHBondContact O-CD 3.33Å; P32-V34 PolarHBondContact O-N 3.38Å; P32-L44 HydrophobicContact CG-CD1 4.03Å
33	L	96.5	Very high	94.8	Very high	71 Å²	71	47.2 Å²	47.2	37%	0.372	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	14.1	176.3	-55.3	179.3	0	0	0	113.1	C31 C35 Y53 E54	C31-L33 PolarHBondContact O-N 3.05Å; C31-L33 VanDerWaalsContact O-N 3.14Å; C31-L33 PolarHBondContact SG-N 2.66Å; C31-L33 VanDerWaalsContact SG-N 3.43Å; L33-C35 PolarHBondContact O-N 2.82Å; L33-Y53 WeakPolarHBondContact O-CD2 3.47Å; L33-E54 WeakPolarHBondContact CD1-OE2 3.5Å
34	V	95.9	Very high	95	Very high	126 Å²	126	47.7 Å²	47.7	76%	0.764	30%	0.303	S	S	*	.			trans	49.3	33.2	176.5	-60.4	0	0	0	0	115.2	C31 P32 G36	C31-V34 WeakPolarHBondContact O-CA 3.31Å; C31-V34 PolarHBondContact O-N 3.09Å; P32-V34 PolarHBondContact O-N 3.38Å; V34-G36 PolarHBondContact O-N 3.27Å; V34-G36 VanDerWaalsContact O-N 3.08Å
35	C	95.9	Very high	95.1	Very high	35 Å²	35	50.1 Å²	50.1	24%	0.236	31%	0.313	C	S	.	.			trans	-72.1	3.3	178.8	76.5	0	0	0	0	114.8	C31 L33 A37 H47 Y53	C31-C35 WeakPolarHBondContact CB-SG 3.42Å; L33-C35 PolarHBondContact O-N 2.82Å; C35-A37 VanDerWaalsContact C-N 3.28Å; C35-A37 PolarHBondContact O-N 3.04Å; C35-A37 VanDerWaalsContact SG-CB 3.54Å; C35-H47 VanDerWaalsContact SG-CE1 3.53Å; C35-H47 PolarHBondContact SG-NE2 3.17Å; C35-Y53 HydrophobicContact CB-CD2 3.66Å; C35-Y53 HydrophobicContact CB-CE2 4.09Å
36	G	95.1	Very high	95.1	Very high	47 Å²	47	53.7 Å²	53.7	49%	0.485	33%	0.329	S	S	.	.	S	Bend	trans	80.1	-3.3	-176.8	0	0	0	0	0	115.3	R14 V34	R14-G36 PolarHBondContact NH2-O 3.18Å; V34-G36 PolarHBondContact O-N 3.27Å; V34-G36 VanDerWaalsContact O-N 3.08Å
37	A	95.6	Very high	95.1	Very high	23 Å²	23	54.2 Å²	54.2	19%	0.19	33%	0.33	C	S	.	.			trans	-74.1	144.3	171.6	0	0	0	0	0	111.7	C31 C35 F39 H47	C31-A37 HydrophobicContact CB-CB 4.42Å; C31-A37 PolarHBondContact N-O 3.35Å; C35-A37 VanDerWaalsContact C-N 3.28Å; C35-A37 PolarHBondContact O-N 3.04Å; C35-A37 VanDerWaalsContact SG-CB 3.54Å; A37-F39 HydrophobicContact CB-CD1 4.01Å; A37-F39 HydrophobicContact CB-CE1 3.94Å; A37-H47 WeakPolarHBondContact CB-CE1 3.46Å
38	V	96.3	Very high	95.1	Very high	54 Å²	54	55 Å²	55	33%	0.327	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.5	174.5	178.6	0	0	0	0	107.1	R14 L28 V29	R14-V38 WeakPolarHBondContact O-CG1 3.48Å; L28-V38 HydrophobicContact CB-CG1 4.12Å; L28-V38 HydrophobicContact CD1-CG1 4.42Å; V29-V38 WeakPolarHBondContact O-CA 3.23Å
39	F	95.4	Very high	95.1	Very high	22 Å²	22	58.4 Å²	58.4	10%	0.096	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	163.4	-171.5	44.5	-96.8	0	0	0	110.4	L28 V29 C31 A37 K43 L44 H47	L28-F39 WeakPolarHBondContact CA-O 3.34Å; V29-F39 HydrophobicContact CG2-CD2 4.06Å; V29-F39 HydrophobicContact CG2-CE2 3.8Å; V29-F39 PolarHBondContact N-O 3.24Å; V29-F39 PolarHBondContact O-N 2.81Å; C31-F39 HydrophobicContact CB-CE1 3.97Å; C31-F39 HydrophobicContact CB-CZ 4.2Å; A37-F39 HydrophobicContact CB-CD1 4.01Å; A37-F39 HydrophobicContact CB-CE1 3.94Å; F39-K43 HydrophobicContact CB-CB 4.38Å; F39-K43 HydrophobicContact CD2-CB 4.32Å; F39-L44 HydrophobicContact CE2-CB 4.12Å; F39-L44 HydrophobicContact CE2-CD1 3.85Å; F39-L44 HydrophobicContact CZ-CD1 3.87Å; F39-H47 HydrophobicContact CD1-CB 4.06Å; F39-H47 AromaticContact CD1-CG 3.81Å; F39-H47 HydrophobicContact CE1-CB 3.72Å; F39-H47 AromaticContact CE1-CD2 3.26Å; F39-H47 WeakPolarHBondContact CE1-CD2 3.33Å; F39-H47 AromaticContact CE1-CG 3.23Å; F39-H47 AromaticContact CE1-ND1 3.74Å; F39-H47 AromaticContact CE1-NE2 3.78Å; F39-H47 HydrophobicContact CE2-CB 4.23Å; F39-H47 HydrophobicContact CG-CB 4.46Å; F39-H47 HydrophobicContact CZ-CB 3.81Å; F39-H47 AromaticContact CZ-CD2 3.48Å; F39-H47 VanDerWaalsContact CZ-CD2 3.48Å; F39-H47 WeakPolarHBondContact CZ-CD2 3.47Å; F39-H47 AromaticContact CZ-CG 3.65Å
40	H	95.7	Very high	95.1	Very high	4 Å²	4	62.2 Å²	62.2	2%	0.019	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	138.8	173.5	-71.6	-75.5	0	0	0	110.7	H7 C8 C11 C26 D27 C42 K43	H7-H40 AromaticContact CD2-CE1 3.91Å; H7-H40 AromaticContact CD2-NE2 3.67Å; H7-H40 AromaticContact NE2-CE1 3.89Å; H7-H40 AromaticContact NE2-NE2 3.48Å; H7-H40 PolarHBondContact NE2-NE2 2.87Å; C8-H40 HydrophobicContact CB-CB 4.01Å; C11-H40 PolarHBondContact SG-NE2 2.94Å; C26-H40 PolarHBondContact O-ND1 3.26Å; D27-H40 CarbonylContact O-C 3.51Å; D27-H40 WeakPolarHBondContact O-CA 3.13Å; H40-C42 PolarHBondContact O-N 2.98Å; H40-C42 VanDerWaalsContact O-N 3.09Å; H40-K43 WeakPolarHBondContact O-CA 3.37Å; H40-K43 WeakPolarHBondContact O-CB 3.42Å; H40-K43 PolarHBondContact O-N 3.43Å
41	S	94.1	Very high	95.2	Very high	52 Å²	52	60.1 Å²	60.1	36%	0.364	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-52.8	-36.1	-173.5	59.5	0	0	0	0	114.4	C26 D27 K43 L44	C26-S41 PolarHBondContact SG-OG 2.91Å; D27-S41 PolarHBondContact O-N 3.09Å; S41-K43 PolarHBondContact O-N 3.08Å; S41-K43 VanDerWaalsContact O-N 3.11Å; S41-L44 WeakPolarHBondContact O-CB 3.44Å; S41-L44 PolarHBondContact O-N 2.8Å; S41-L44 VanDerWaalsContact O-N 3.11Å
42	C	93.8	Very high	95.2	Very high	39 Å²	39	62.3 Å²	62.3	26%	0.264	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-65.2	-11	176	71.1	0	0	0	0	114.5	L4 C8 C26 H40	L4-C42 HydrophobicContact CD2-CB 4.43Å; L4-C42 VanDerWaalsContact CD2-O 3.29Å; L4-C42 WeakPolarHBondContact CD2-O 3.35Å; C8-C42 WeakPolarHBondContact CB-SG 3.36Å; C26-C42 VanDerWaalsContact SG-SG 3.66Å; H40-C42 PolarHBondContact O-N 2.98Å; H40-C42 VanDerWaalsContact O-N 3.09Å
43	K	94.2	Very high	95.3	Very high	29 Å²	29	62.2 Å²	62.2	13%	0.126	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-95.3	6.8	175	-66.5	-164.7	153.9	178.1	0	113.7	L4 C8 L9 C11 F39 H40 S41 D45 E46 H47	L4-K43 HydrophobicContact CD2-CG 4.11Å; C8-K43 WeakPolarHBondContact O-CE 3.46Å; C8-K43 PolarHBondContact O-NZ 2.94Å; L9-K43 PolarHBondContact O-NZ 3.03Å; C11-K43 PolarHBondContact O-NZ 3Å; F39-K43 HydrophobicContact CB-CB 4.38Å; F39-K43 HydrophobicContact CD2-CB 4.32Å; H40-K43 WeakPolarHBondContact O-CA 3.37Å; H40-K43 WeakPolarHBondContact O-CB 3.42Å; H40-K43 PolarHBondContact O-N 3.43Å; S41-K43 PolarHBondContact O-N 3.08Å; S41-K43 VanDerWaalsContact O-N 3.11Å; K43-D45 PolarHBondContact O-N 3.49Å; K43-E46 WeakPolarHBondContact CE-OE2 3.06Å; K43-E46 WeakPolarHBondContact CG-OE2 3.36Å; K43-E46 PolarHBondContact O-N 3.36Å; K43-H47 WeakPolarHBondContact O-CB 3.1Å; K43-H47 PolarHBondContact O-N 3.18Å
44	L	93.3	Very high	95.3	Very high	57 Å²	57	59.9 Å²	59.9	30%	0.298	33%	0.329	S	S	.	.	H	α-helix	trans	-56.3	-48.5	-177.7	178.7	59.1	0	0	0	111.9	P32 F39 S41 H47 R48	P32-L44 HydrophobicContact CG-CD1 4.03Å; F39-L44 HydrophobicContact CE2-CB 4.12Å; F39-L44 HydrophobicContact CE2-CD1 3.85Å; F39-L44 HydrophobicContact CZ-CD1 3.87Å; S41-L44 WeakPolarHBondContact O-CB 3.44Å; S41-L44 PolarHBondContact O-N 2.8Å; S41-L44 VanDerWaalsContact O-N 3.11Å; L44-H47 WeakPolarHBondContact O-CB 3.24Å; L44-H47 PolarHBondContact O-N 2.88Å; L44-H47 VanDerWaalsContact O-N 3.16Å; L44-R48 WeakPolarHBondContact O-CG 3.25Å; L44-R48 PolarHBondContact O-N 2.93Å
45	D	93.2	Very high	95.4	Very high	113 Å²	113	60.9 Å²	60.9	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-68.5	-39.2	-178.4	-63.7	-42.2	0	0	0	112.5	K43 H47 R48 L49	K43-D45 PolarHBondContact O-N 3.49Å; D45-H47 VanDerWaalsContact C-N 3.27Å; D45-H47 PolarHBondContact O-N 3.41Å; D45-R48 PolarHBondContact O-N 2.97Å; D45-L49 PolarHBondContact O-N 3.26Å
46	E	93.5	Very high	95.5	Very high	81 Å²	81	61.9 Å²	61.9	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-57.2	-42.1	170.2	-62.6	-170.3	138.6	0	0	111.3	L4 K43 L49	L4-E46 VanDerWaalsContact CD1-OE1 3.28Å; L4-E46 WeakPolarHBondContact CD1-OE1 3.14Å; K43-E46 WeakPolarHBondContact CE-OE2 3.06Å; K43-E46 WeakPolarHBondContact CG-OE2 3.36Å; K43-E46 PolarHBondContact O-N 3.36Å; E46-L49 WeakPolarHBondContact O-CB 3.42Å; E46-L49 PolarHBondContact O-N 3.37Å
47	H	94.6	Very high	95.6	Very high	26 Å²	26	63.1 Å²	63.1	12%	0.12	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-37.7	179	175.8	65.8	0	0	0	112.5	C31 C35 A37 F39 K43 L44 D45 L49 L50 C51	C31-H47 PolarHBondContact SG-NE2 3.42Å; C35-H47 VanDerWaalsContact SG-CE1 3.53Å; C35-H47 PolarHBondContact SG-NE2 3.17Å; A37-H47 WeakPolarHBondContact CB-CE1 3.46Å; F39-H47 HydrophobicContact CD1-CB 4.06Å; F39-H47 AromaticContact CD1-CG 3.81Å; F39-H47 HydrophobicContact CE1-CB 3.72Å; F39-H47 AromaticContact CE1-CD2 3.26Å; F39-H47 WeakPolarHBondContact CE1-CD2 3.33Å; F39-H47 AromaticContact CE1-CG 3.23Å; F39-H47 AromaticContact CE1-ND1 3.74Å; F39-H47 AromaticContact CE1-NE2 3.78Å; F39-H47 HydrophobicContact CE2-CB 4.23Å; F39-H47 HydrophobicContact CG-CB 4.46Å; F39-H47 HydrophobicContact CZ-CB 3.81Å; F39-H47 AromaticContact CZ-CD2 3.48Å; F39-H47 VanDerWaalsContact CZ-CD2 3.48Å; F39-H47 WeakPolarHBondContact CZ-CD2 3.47Å; F39-H47 AromaticContact CZ-CG 3.65Å; K43-H47 WeakPolarHBondContact O-CB 3.1Å; K43-H47 PolarHBondContact O-N 3.18Å; L44-H47 WeakPolarHBondContact O-CB 3.24Å; L44-H47 PolarHBondContact O-N 2.88Å; L44-H47 VanDerWaalsContact O-N 3.16Å; D45-H47 VanDerWaalsContact C-N 3.27Å; D45-H47 PolarHBondContact O-N 3.41Å; H47-L49 PolarHBondContact O-N 3.38Å; H47-L50 CarbonylContact O-C 3.59Å; H47-L50 WeakPolarHBondContact O-CA 3.44Å; H47-L50 PolarHBondContact O-N 3.26Å; H47-C51 WeakPolarHBondContact O-CB 3.38Å; H47-C51 PolarHBondContact O-N 2.98Å
48	R	95.2	Very high	95.7	Very high	119 Å²	119	62.1 Å²	62.1	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-34.7	177.4	-68.3	177.6	74.9	-179.9	1.6	112.1	L44 D45 L50 C51 E54 R71	L44-R48 WeakPolarHBondContact O-CG 3.25Å; L44-R48 PolarHBondContact O-N 2.93Å; D45-R48 PolarHBondContact O-N 2.97Å; R48-L50 PolarHBondContact O-N 3.28Å; R48-L50 VanDerWaalsContact O-N 3.15Å; R48-C51 PolarHBondContact O-N 2.95Å; R48-E54 HydrophobicContact CB-CG 4.4Å; R48-E54 WeakPolarHBondContact CG-OE2 3.24Å; R48-E54 IonicContact CZ-OE1 2.69Å; R48-E54 VanDerWaalsContact CZ-OE1 3.26Å; R48-E54 IonicContact NE-OE1 3.5Å; R48-E54 PolarHBondContact NE-OE1 3.36Å; R48-E54 IonicContact NE-OE2 3.92Å; R48-E54 PolarHBondContact NE-OE2 2.9Å; R48-E54 IonicContact NH2-OE1 2.73Å; R48-E54 PolarHBondContact NH2-OE1 2.87Å; R48-R71 PolarHBondContact O-NH2 3.05Å
49	L	94.6	Very high	95.7	Very high	128 Å²	128	65.4 Å²	65.4	67%	0.67	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.7	173.1	-58.9	178	0	0	0	114	D45 E46 H47 R71	D45-L49 PolarHBondContact O-N 3.26Å; E46-L49 WeakPolarHBondContact O-CB 3.42Å; E46-L49 PolarHBondContact O-N 3.37Å; H47-L49 PolarHBondContact O-N 3.38Å; L49-R71 PolarHBondContact O-NH1 3.02Å; L49-R71 PolarHBondContact O-NH2 2.85Å
50	L	95.5	Very high	95.8	Very high	133 Å²	133	65.6 Å²	65.6	70%	0.696	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-19.7	-179.8	-59.8	177.4	0	0	0	113.6	H47 R48	H47-L50 CarbonylContact O-C 3.59Å; H47-L50 WeakPolarHBondContact O-CA 3.44Å; H47-L50 PolarHBondContact O-N 3.26Å; R48-L50 PolarHBondContact O-N 3.28Å; R48-L50 VanDerWaalsContact O-N 3.15Å
51	C	97.3	Very high	95.8	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.346	C	S	.	.			trans	-60.8	126.6	-170.6	-179.1	0	0	0	0	111.8	H47 R48 Y53 E54 R71	H47-C51 WeakPolarHBondContact O-CB 3.38Å; H47-C51 PolarHBondContact O-N 2.98Å; R48-C51 PolarHBondContact O-N 2.95Å; C51-Y53 PolarHBondContact O-N 3.38Å; C51-Y53 PolarHBondContact SG-N 2.67Å; C51-E54 HydrophobicContact CB-CB 4.13Å; C51-E54 PolarHBondContact O-N 3.44Å; C51-R71 PolarHBondContact O-NE 2.75Å; C51-R71 VanDerWaalsContact O-NE 3.09Å
52	P	97.6	Very high	95.8	Very high	55 Å²	55	68 Å²	68	36%	0.357	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.4	177.5	-23.4	34	0	0	0	114	R71 I72	P52-R71 PolarHBondContact O-N 3.37Å; P52-I72 HydrophobicContact CB-CB 4.05Å; P52-I72 HydrophobicContact CB-CD1 4.35Å; P52-I72 WeakPolarHBondContact O-CB 3.23Å; P52-I72 WeakPolarHBondContact O-CG2 3.29Å; P52-I72 PolarHBondContact O-N 2.78Å
53	Y	97.8	Very high	95.8	Very high	92 Å²	92	71 Å²	71	36%	0.361	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-4	-179.3	-61.3	-36.6	0	0	0	114	L33 C35 C51 R55 K70 I72	L33-Y53 WeakPolarHBondContact O-CD2 3.47Å; C35-Y53 HydrophobicContact CB-CD2 3.66Å; C35-Y53 HydrophobicContact CB-CE2 4.09Å; C51-Y53 PolarHBondContact O-N 3.38Å; C51-Y53 PolarHBondContact SG-N 2.67Å; Y53-R55 PolarHBondContact O-N 3.02Å; Y53-K70 HydrophobicContact CD1-CD 4.33Å; Y53-I72 HydrophobicContact CD1-CG2 3.9Å; Y53-I72 HydrophobicContact CE1-CD1 4.28Å; Y53-I72 HydrophobicContact CE1-CG2 3.99Å
54	E	97.7	Very high	95.8	Very high	22 Å²	22	70.3 Å²	70.3	10%	0.103	37%	0.366	C	S	.	.			trans	-57.2	134.8	171.2	-162.2	66.4	-153.3	0	0	109.6	L33 R48 C51 L56 K70 R71	L33-E54 WeakPolarHBondContact CD1-OE2 3.5Å; R48-E54 HydrophobicContact CB-CG 4.4Å; R48-E54 WeakPolarHBondContact CG-OE2 3.24Å; R48-E54 IonicContact CZ-OE1 2.69Å; R48-E54 VanDerWaalsContact CZ-OE1 3.26Å; R48-E54 IonicContact NE-OE1 3.5Å; R48-E54 PolarHBondContact NE-OE1 3.36Å; R48-E54 IonicContact NE-OE2 3.92Å; R48-E54 PolarHBondContact NE-OE2 2.9Å; R48-E54 IonicContact NH2-OE1 2.73Å; R48-E54 PolarHBondContact NH2-OE1 2.87Å; C51-E54 HydrophobicContact CB-CB 4.13Å; C51-E54 PolarHBondContact O-N 3.44Å; E54-L56 HydrophobicContact CG-CD2 4.33Å; E54-K70 CarbonylContact O-C 3.55Å; E54-K70 WeakPolarHBondContact O-CA 3.5Å; E54-R71 PolarHBondContact O-N 3.1Å
55	R	97.5	Very high	96	Very high	147 Å²	147	67.9 Å²	67.9	56%	0.555	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.7	175.9	-73.9	-178.1	64.7	76	4.3	108.5	Y53 T68 V69 K70	Y53-R55 PolarHBondContact O-N 3.02Å; R55-T68 HydrophobicContact CB-CG2 3.88Å; R55-T68 PolarHBondContact NH2-O 3.14Å; R55-V69 WeakPolarHBondContact CA-O 3.44Å; R55-K70 HydrophobicContact CG-CG 4.1Å
56	L	96.8	Very high	96.1	Very high	56 Å²	56	65.9 Å²	65.9	29%	0.293	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	152	178.7	-65.9	-179.1	0	0	0	110.1	E54 T68 V69	E54-L56 HydrophobicContact CG-CD2 4.33Å; L56-T68 CarbonylContact O-C 3.55Å; L56-T68 WeakPolarHBondContact O-CA 3.47Å; L56-T68 WeakPolarHBondContact O-CG2 3.3Å; L56-V69 PolarHBondContact N-O 3.14Å; L56-V69 PolarHBondContact O-N 3.44Å
57	P	98	Very high	96.2	Very high	74 Å²	74	65 Å²	65	48%	0.481	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	147.3	165.6	26.8	-35.2	0	0	0	109.9	M74	P57-M74 WeakPolarHBondContact O-CE 3.43Å
58	C	97.3	Very high	96.4	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.007	35%	0.354	C	S	.	.			trans	-51.4	146.3	171.7	179.3	0	0	0	0	111.3	N60 S61 C65 F67 H77 C81	C58-N60 PolarHBondContact O-N 2.88Å; C58-N60 VanDerWaalsContact O-N 3.07Å; C58-N60 PolarHBondContact SG-N 2.84Å; C58-N60 VanDerWaalsContact SG-N 3.36Å; C58-S61 VanDerWaalsContact O-CB 3.25Å; C58-S61 WeakPolarHBondContact O-CB 3.33Å; C58-S61 PolarHBondContact O-N 3.35Å; C58-S61 PolarHBondContact O-OG 3.02Å; C58-S61 VanDerWaalsContact O-OG 3.09Å; C58-C65 HydrophobicContact CB-CB 3.92Å; C58-C65 VanDerWaalsContact CB-SG 3.53Å; C58-C65 VanDerWaalsContact SG-SG 3.65Å; C58-F67 WeakPolarHBondContact CB-O 3.44Å; C58-F67 PolarHBondContact N-O 2.81Å; C58-H77 PolarHBondContact SG-CD2 2.78Å; C58-H77 PolarHBondContact SG-NE2 2.9Å; C58-C81 VanDerWaalsContact SG-SG 3.67Å
59	L	96.9	Very high	96.4	Very high	124 Å²	124	62 Å²	62	65%	0.649	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.1	173.9	-58.6	-175	0	0	0	112.6	M74 L78	L59-M74 HydrophobicContact CD1-CG 4.27Å; L59-M74 HydrophobicContact CD2-CE 4.38Å; L59-M74 HydrophobicContact CG-CE 4.32Å; L59-M74 HydrophobicContact CG-CG 4.03Å; L59-M74 HydrophobicContact CG-SD 3.98Å; L59-L78 HydrophobicContact CD1-CD1 4.03Å
60	N	96.6	Very high	96.6	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.134	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	19.5	177.5	-56.1	-29.6	0	0	0	112.9	C58 G62 F63 G64 C65 L78 A83	C58-N60 PolarHBondContact O-N 2.88Å; C58-N60 VanDerWaalsContact O-N 3.07Å; C58-N60 PolarHBondContact SG-N 2.84Å; C58-N60 VanDerWaalsContact SG-N 3.36Å; N60-G62 VanDerWaalsContact C-N 3.28Å; N60-G62 PolarHBondContact O-N 3.49Å; N60-F63 HydrophobicContact CB-CB 4.46Å; N60-F63 HydrophobicContact CB-CD2 3.98Å; N60-F63 CarbonylContact O-C 3.57Å; N60-F63 WeakPolarHBondContact O-CA 3.43Å; N60-F63 WeakPolarHBondContact O-CB 3.46Å; N60-F63 PolarHBondContact O-N 3.34Å; N60-G64 PolarHBondContact O-N 2.88Å; N60-C65 HydrophobicContact CB-CB 4.3Å; N60-C65 WeakPolarHBondContact O-CB 3.32Å; N60-C65 PolarHBondContact O-N 3.09Å; N60-C65 VanDerWaalsContact O-N 3.14Å; N60-L78 WeakPolarHBondContact ND2-CD2 3.47Å; N60-A83 HydrophobicContact CB-CB 3.85Å
61	S	96.4	Very high	96.7	Very high	51 Å²	51	58.3 Å²	58.3	36%	0.357	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.8	175.5	59.8	0	0	0	0	112.2	C58 F63 G64	C58-S61 VanDerWaalsContact O-CB 3.25Å; C58-S61 WeakPolarHBondContact O-CB 3.33Å; C58-S61 PolarHBondContact O-N 3.35Å; C58-S61 PolarHBondContact O-OG 3.02Å; C58-S61 VanDerWaalsContact O-OG 3.09Å; S61-F63 PolarHBondContact O-N 2.84Å; S61-G64 WeakPolarHBondContact O-CA 3.44Å; S61-G64 PolarHBondContact O-N 2.64Å
62	G	94.4	Very high	96.7	Very high	55 Å²	55	63 Å²	63	57%	0.567	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.8	172.3	0	0	0	0	0	113.2	N60 G64 K643	N60-G62 VanDerWaalsContact C-N 3.28Å; N60-G62 PolarHBondContact O-N 3.49Å; G62-G64 VanDerWaalsContact C-N 3.33Å; G62-K643 WeakPolarHBondContact O-CE 3.01Å; G62-K643 PolarHBondContact O-NZ 2.9Å
63	F	94	Very high	96.7	Very high	102 Å²	102	65.7 Å²	65.7	45%	0.447	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.3	175.1	-57.2	-54.2	0	0	0	114	N60 S61 A83 V622 L624	N60-F63 HydrophobicContact CB-CB 4.46Å; N60-F63 HydrophobicContact CB-CD2 3.98Å; N60-F63 CarbonylContact O-C 3.57Å; N60-F63 WeakPolarHBondContact O-CA 3.43Å; N60-F63 WeakPolarHBondContact O-CB 3.46Å; N60-F63 PolarHBondContact O-N 3.34Å; S61-F63 PolarHBondContact O-N 2.84Å; F63-A83 HydrophobicContact CB-CB 3.94Å; F63-V622 WeakPolarHBondContact O-CG1 3.4Å; F63-L624 HydrophobicContact CD1-CD1 3.72Å; F63-L624 HydrophobicContact CE1-CD1 4.24Å
64	G	94.3	Very high	96.7	Very high	16 Å²	16	62.2 Å²	62.2	17%	0.165	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.1	12.9	175.1	0	0	0	0	0	115.8	N60 S61 G62 P66	N60-G64 PolarHBondContact O-N 2.88Å; S61-G64 WeakPolarHBondContact O-CA 3.44Å; S61-G64 PolarHBondContact O-N 2.64Å; G62-G64 VanDerWaalsContact C-N 3.33Å; G64-P66 WeakPolarHBondContact O-CD 3.49Å
65	C	96.1	Very high	96.6	Very high	6 Å²	6	64.5 Å²	64.5	4%	0.041	35%	0.349	C	S	.	.			trans	-68.7	120.2	170.1	-174.5	0	0	0	0	111	C58 N60 F67 H77 C81 A83	C58-C65 HydrophobicContact CB-CB 3.92Å; C58-C65 VanDerWaalsContact CB-SG 3.53Å; C58-C65 VanDerWaalsContact SG-SG 3.65Å; N60-C65 HydrophobicContact CB-CB 4.3Å; N60-C65 WeakPolarHBondContact O-CB 3.32Å; N60-C65 PolarHBondContact O-N 3.09Å; N60-C65 VanDerWaalsContact O-N 3.14Å; C65-F67 VanDerWaalsContact C-N 3.29Å; C65-F67 PolarHBondContact O-N 2.89Å; C65-H77 PolarHBondContact SG-NE2 3.04Å; C65-C81 VanDerWaalsContact SG-SG 3.65Å; C65-A83 HydrophobicContact CB-CB 3.87Å
66	P	95.4	Very high	96.5	Very high	71 Å²	71	62.6 Å²	62.6	46%	0.461	35%	0.347	S	S	.	.			trans	-81	-10.2	-176.9	33.6	-35.7	0	0	0	112.9	G64 W645	G64-P66 WeakPolarHBondContact O-CD 3.49Å; P66-W645 HydrophobicContact CG-CH2 4.17Å; P66-W645 HydrophobicContact CG-CZ2 4.04Å
67	F	96.2	Very high	96.5	Very high	62 Å²	62	61 Å²	61	27%	0.272	34%	0.338	S	S	.	.			trans	-80.8	128.6	-168.5	-63.5	-69.5	0	0	0	113.1	C58 C65 V69 H77 P82 M618	C58-F67 WeakPolarHBondContact CB-O 3.44Å; C58-F67 PolarHBondContact N-O 2.81Å; C65-F67 VanDerWaalsContact C-N 3.29Å; C65-F67 PolarHBondContact O-N 2.89Å; F67-V69 HydrophobicContact CB-CG1 4.2Å; F67-H77 AromaticContact CD2-CE1 3.7Å; F67-P82 HydrophobicContact CD2-CG 4.34Å; F67-P82 HydrophobicContact CE2-CG 4.03Å; F67-M618 HydrophobicContact CZ-SD 4.12Å
68	T	97.8	Very high	96.4	Very high	61 Å²	61	59.4 Å²	59.4	37%	0.374	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.1	163.5	-65.3	0	0	0	0	109.2	R55 L56	R55-T68 HydrophobicContact CB-CG2 3.88Å; R55-T68 PolarHBondContact NH2-O 3.14Å; L56-T68 CarbonylContact O-C 3.55Å; L56-T68 WeakPolarHBondContact O-CA 3.47Å; L56-T68 WeakPolarHBondContact O-CG2 3.3Å
69	V	97.1	Very high	96.2	Very high	21 Å²	21	64.9 Å²	64.9	13%	0.127	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.4	-171.4	-60.9	0	0	0	0	111.9	R55 L56 F67 M74 H77	R55-V69 WeakPolarHBondContact CA-O 3.44Å; L56-V69 PolarHBondContact N-O 3.14Å; L56-V69 PolarHBondContact O-N 3.44Å; F67-V69 HydrophobicContact CB-CG1 4.2Å; V69-M74 HydrophobicContact CG2-CB 4.44Å; V69-M74 HydrophobicContact CG2-CE 3.45Å; V69-M74 VanDerWaalsContact CG2-CE 3.45Å; V69-M74 HydrophobicContact CG2-SD 3.5Å; V69-M74 VanDerWaalsContact CG2-SD 3.5Å; V69-H77 HydrophobicContact CG1-CB 4.08Å; V69-H77 HydrophobicContact CG2-CB 4.48Å
70	K	97.8	Very high	96.1	Very high	95 Å²	95	62.2 Å²	62.2	41%	0.413	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	138.1	172	-66.1	-174.5	178.1	-177.8	0	109.1	Y53 E54 R55 I72 K73 M74	Y53-K70 HydrophobicContact CD1-CD 4.33Å; E54-K70 CarbonylContact O-C 3.55Å; E54-K70 WeakPolarHBondContact O-CA 3.5Å; R55-K70 HydrophobicContact CG-CG 4.1Å; K70-I72 VanDerWaalsContact C-N 3.26Å; K70-I72 HydrophobicContact CB-CG2 4.28Å; K70-I72 PolarHBondContact O-N 3.27Å; K70-I72 VanDerWaalsContact O-N 3.14Å; K70-K73 HydrophobicContact CB-CB 4.49Å; K70-K73 CarbonylContact O-C 3.5Å; K70-K73 WeakPolarHBondContact O-CA 3.21Å; K70-K73 PolarHBondContact O-N 3.44Å; K70-M74 PolarHBondContact O-N 3.29Å
71	R	97.1	Very high	96.1	Very high	88 Å²	88	61 Å²	61	33%	0.332	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-48.3	-44.7	-179.4	-172.6	-171.8	-57.8	-94.2	2.3	113.3	R48 L49 C51 P52 E54 K73 M74	R48-R71 PolarHBondContact O-NH2 3.05Å; L49-R71 PolarHBondContact O-NH1 3.02Å; L49-R71 PolarHBondContact O-NH2 2.85Å; C51-R71 PolarHBondContact O-NE 2.75Å; C51-R71 VanDerWaalsContact O-NE 3.09Å; P52-R71 PolarHBondContact O-N 3.37Å; E54-R71 PolarHBondContact O-N 3.1Å; R71-K73 PolarHBondContact O-N 3.03Å; R71-M74 VanDerWaalsContact O-CB 3.27Å; R71-M74 WeakPolarHBondContact O-CB 3.26Å; R71-M74 PolarHBondContact O-N 2.7Å; R71-M74 VanDerWaalsContact O-N 3.15Å
72	I	97.2	Very high	96.1	Very high	100 Å²	100	58.7 Å²	58.7	51%	0.513	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-64.3	-21.5	177.6	-162.9	170.2	0	0	0	114.3	P52 Y53 K70	P52-I72 HydrophobicContact CB-CB 4.05Å; P52-I72 HydrophobicContact CB-CD1 4.35Å; P52-I72 WeakPolarHBondContact O-CB 3.23Å; P52-I72 WeakPolarHBondContact O-CG2 3.29Å; P52-I72 PolarHBondContact O-N 2.78Å; Y53-I72 HydrophobicContact CD1-CG2 3.9Å; Y53-I72 HydrophobicContact CE1-CD1 4.28Å; Y53-I72 HydrophobicContact CE1-CG2 3.99Å; K70-I72 VanDerWaalsContact C-N 3.26Å; K70-I72 HydrophobicContact CB-CG2 4.28Å; K70-I72 PolarHBondContact O-N 3.27Å; K70-I72 VanDerWaalsContact O-N 3.14Å
73	K	97.8	Very high	96.2	Very high	110 Å²	110	56.5 Å²	56.5	48%	0.478	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-99.5	0.8	177.5	-69.4	-56.2	-161.3	171.5	0	113.3	K70 R71 A75 Q76 H77	K70-K73 HydrophobicContact CB-CB 4.49Å; K70-K73 CarbonylContact O-C 3.5Å; K70-K73 WeakPolarHBondContact O-CA 3.21Å; K70-K73 PolarHBondContact O-N 3.44Å; R71-K73 PolarHBondContact O-N 3.03Å; K73-A75 PolarHBondContact O-N 3Å; K73-Q76 PolarHBondContact O-N 3.23Å; K73-H77 PolarHBondContact O-N 3.03Å
74	M	97.3	Very high	96.3	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-45	-178.9	-172	65.1	75.6	0	0	112.2	P57 L59 V69 K70 R71 H77 L78	P57-M74 WeakPolarHBondContact O-CE 3.43Å; L59-M74 HydrophobicContact CD1-CG 4.27Å; L59-M74 HydrophobicContact CD2-CE 4.38Å; L59-M74 HydrophobicContact CG-CE 4.32Å; L59-M74 HydrophobicContact CG-CG 4.03Å; L59-M74 HydrophobicContact CG-SD 3.98Å; V69-M74 HydrophobicContact CG2-CB 4.44Å; V69-M74 HydrophobicContact CG2-CE 3.45Å; V69-M74 VanDerWaalsContact CG2-CE 3.45Å; V69-M74 HydrophobicContact CG2-SD 3.5Å; V69-M74 VanDerWaalsContact CG2-SD 3.5Å; K70-M74 PolarHBondContact O-N 3.29Å; R71-M74 VanDerWaalsContact O-CB 3.27Å; R71-M74 WeakPolarHBondContact O-CB 3.26Å; R71-M74 PolarHBondContact O-N 2.7Å; R71-M74 VanDerWaalsContact O-N 3.15Å; M74-H77 PolarHBondContact O-N 2.9Å; M74-L78 HydrophobicContact CG-CD1 4.06Å; M74-L78 HydrophobicContact CG-CG 4.46Å; M74-L78 VanDerWaalsContact O-CG 3.27Å; M74-L78 WeakPolarHBondContact O-CG 3.4Å; M74-L78 PolarHBondContact O-N 3.49Å
75	A	96.1	Very high	96.3	Very high	70 Å²	70	53.6 Å²	53.6	58%	0.579	28%	0.279	S	S	*	.	H	α-helix	trans	-60.2	-49.9	178.7	0	0	0	0	0	112.2	K73 H77 L78 E79	K73-A75 PolarHBondContact O-N 3Å; A75-H77 VanDerWaalsContact C-N 3.27Å; A75-H77 PolarHBondContact O-N 3.39Å; A75-L78 PolarHBondContact O-N 3.37Å; A75-L78 VanDerWaalsContact O-N 3.1Å; A75-E79 PolarHBondContact O-N 3.17Å
76	Q	96.3	Very high	96.2	Very high	107 Å²	107	54.9 Å²	54.9	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-36.9	176.3	-173.6	179.9	5.6	0	0	112.1	K73	K73-Q76 PolarHBondContact O-N 3.23Å
77	H	96.1	Very high	96.2	Very high	24 Å²	24	54.3 Å²	54.3	11%	0.111	28%	0.284	C	S	.	.	H	α-helix	trans	-67.9	-38.1	175.3	170.3	56.8	0	0	0	112.5	C58 C65 F67 V69 K73 M74 A75 E79 T80 C81	C58-H77 PolarHBondContact SG-CD2 2.78Å; C58-H77 PolarHBondContact SG-NE2 2.9Å; C65-H77 PolarHBondContact SG-NE2 3.04Å; F67-H77 AromaticContact CD2-CE1 3.7Å; V69-H77 HydrophobicContact CG1-CB 4.08Å; V69-H77 HydrophobicContact CG2-CB 4.48Å; K73-H77 PolarHBondContact O-N 3.03Å; M74-H77 PolarHBondContact O-N 2.9Å; A75-H77 VanDerWaalsContact C-N 3.27Å; A75-H77 PolarHBondContact O-N 3.39Å; H77-E79 PolarHBondContact O-N 3.39Å; H77-T80 CarbonylContact O-C 3.59Å; H77-T80 PolarHBondContact O-N 3.1Å; H77-C81 WeakPolarHBondContact O-CA 3.29Å; H77-C81 VanDerWaalsContact O-CB 3.24Å; H77-C81 WeakPolarHBondContact O-CB 3.32Å; H77-C81 PolarHBondContact O-N 3.17Å
78	L	95.7	Very high	96.2	Very high	39 Å²	39	51.3 Å²	51.3	20%	0.204	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-22.6	-177.6	-72.3	166.9	0	0	0	113.7	L59 N60 M74 A75 T80	L59-L78 HydrophobicContact CD1-CD1 4.03Å; N60-L78 WeakPolarHBondContact ND2-CD2 3.47Å; M74-L78 HydrophobicContact CG-CD1 4.06Å; M74-L78 HydrophobicContact CG-CG 4.46Å; M74-L78 VanDerWaalsContact O-CG 3.27Å; M74-L78 WeakPolarHBondContact O-CG 3.4Å; M74-L78 PolarHBondContact O-N 3.49Å; A75-L78 PolarHBondContact O-N 3.37Å; A75-L78 VanDerWaalsContact O-N 3.1Å; L78-T80 VanDerWaalsContact C-N 3.35Å
79	E	93.7	Very high	95.9	Very high	117 Å²	117	52.5 Å²	52.5	55%	0.547	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-40	173	-67.6	169.4	-175.5	0	0	111.9	A75 H77 D493	A75-E79 PolarHBondContact O-N 3.17Å; H77-E79 PolarHBondContact O-N 3.39Å; E79-D493 WeakPolarHBondContact O-CB 3.46Å; E79-D493 PolarHBondContact O-N 3.33Å
80	T	94.4	Very high	95.7	Very high	68 Å²	68	54.3 Å²	54.3	42%	0.417	29%	0.286	S	S	.	.	S	Bend	trans	-114.7	17.1	-176.3	64	0	0	0	0	113	H77 L78 R491 D493	H77-T80 CarbonylContact O-C 3.59Å; H77-T80 PolarHBondContact O-N 3.1Å; L78-T80 VanDerWaalsContact C-N 3.35Å; T80-R491 PolarHBondContact O-NH2 2.83Å; T80-D493 WeakPolarHBondContact CG2-OD2 3.47Å
81	C	96.6	Very high	95.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.275	C	S	.	.			trans	-73	126.7	-174.6	170.4	0	0	0	0	110.5	C58 C65 H77 A83 S84	C58-C81 VanDerWaalsContact SG-SG 3.67Å; C65-C81 VanDerWaalsContact SG-SG 3.65Å; H77-C81 WeakPolarHBondContact O-CA 3.29Å; H77-C81 VanDerWaalsContact O-CB 3.24Å; H77-C81 WeakPolarHBondContact O-CB 3.32Å; H77-C81 PolarHBondContact O-N 3.17Å; C81-A83 PolarHBondContact O-N 3.29Å; C81-A83 VanDerWaalsContact O-N 3.13Å; C81-S84 PolarHBondContact O-N 3.35Å
82	P	96.7	Very high	94.9	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.013	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.9	-176.4	27.7	-36.6	0	0	0	113.2	F67 G620 M621 V622 W645	F67-P82 HydrophobicContact CD2-CG 4.34Å; F67-P82 HydrophobicContact CE2-CG 4.03Å; P82-G620 WeakPolarHBondContact CB-O 3.48Å; P82-M621 CarbonylContact O-C 3.47Å; P82-M621 WeakPolarHBondContact O-CA 3.5Å; P82-M621 WeakPolarHBondContact O-CB 2.97Å; P82-V622 HydrophobicContact CB-CG2 4.35Å; P82-V622 PolarHBondContact O-N 2.78Å; P82-W645 HydrophobicContact CB-CH2 3.78Å; P82-W645 HydrophobicContact CB-CZ3 3.51Å; P82-W645 HydrophobicContact CG-CH2 3.66Å; P82-W645 HydrophobicContact CG-CZ3 3.94Å
83	A	96.6	Very high	94.5	Very high	9 Å²	9	43.5 Å²	43.5	7%	0.074	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	11.6	173.3	0	0	0	0	0	113.3	N60 F63 C65 C81 I85 V622	N60-A83 HydrophobicContact CB-CB 3.85Å; F63-A83 HydrophobicContact CB-CB 3.94Å; C65-A83 HydrophobicContact CB-CB 3.87Å; C81-A83 PolarHBondContact O-N 3.29Å; C81-A83 VanDerWaalsContact O-N 3.13Å; A83-I85 PolarHBondContact O-N 3.03Å; A83-V622 HydrophobicContact CB-CB 4.38Å
84	S	95.7	Very high	94	Very high	11 Å²	11	38.3 Å²	38.3	8%	0.077	22%	0.215	C	C	.	.			trans	-96.2	74.7	165.5	-156	0	0	0	0	109.8	C81 R492	C81-S84 PolarHBondContact O-N 3.35Å; S84-R492 PolarHBondContact O-N 2.88Å; S84-R492 PolarHBondContact OG-NE 3.3Å
85	I	94.6	Very high	93.3	Very high	46 Å²	46	39.9 Å²	39.9	24%	0.236	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	144.2	-178.4	-62.1	-173.4	0	0	0	110.9	A83 L489 F490 M621 V622 V623	A83-I85 PolarHBondContact O-N 3.03Å; I85-L489 HydrophobicContact CG2-CB 3.88Å; I85-L489 HydrophobicContact CG2-CD2 4.1Å; I85-L489 HydrophobicContact CG2-CG 4.39Å; I85-F490 CarbonylContact C-O 3.51Å; I85-F490 VanDerWaalsContact CA-O 3.29Å; I85-F490 WeakPolarHBondContact CA-O 3.32Å; I85-F490 WeakPolarHBondContact CG2-O 3.3Å; I85-M621 HydrophobicContact CD1-CB 3.78Å; I85-M621 HydrophobicContact CD1-CG 3.89Å; I85-M621 HydrophobicContact CD1-SD 3.83Å; I85-M621 HydrophobicContact CG1-CB 4.08Å; I85-M621 HydrophobicContact CG1-SD 4.28Å; I85-V622 WeakPolarHBondContact CD1-O 3.41Å; I85-V623 HydrophobicContact CD1-CG2 3.63Å
86	V	94.9	Very high	92.5	Very high	32 Å²	32	38.5 Å²	38.5	19%	0.194	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.1	172.2	-178.8	0	0	0	0	108.5	F490 R492 F495	V86-F490 PolarHBondContact N-O 2.78Å; V86-F490 PolarHBondContact O-N 2.68Å; V86-R492 HydrophobicContact CG2-CB 4.35Å; V86-F495 HydrophobicContact CB-CB 4.42Å; V86-F495 HydrophobicContact CB-CD2 4.37Å; V86-F495 HydrophobicContact CB-CG 4.43Å; V86-F495 HydrophobicContact CG1-CB 4.48Å; V86-F495 HydrophobicContact CG1-CD2 3.74Å; V86-F495 HydrophobicContact CG1-CE2 4.11Å; V86-F495 HydrophobicContact CG1-CG 3.96Å
87	C	95.5	Very high	91.4	Very high	59 Å²	59	34.5 Å²	34.5	40%	0.399	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.8	170.3	-177.8	0	0	0	0	109.9	T89 L489	C87-T89 PolarHBondContact O-N 3.09Å; C87-L489 HydrophobicContact CB-CD2 3.63Å
88	C	95.3	Very high	90.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.202	C	C	.	.			trans	-76.6	111.3	175.7	-169.9	0	0	0	0	111.1	M90 C486 G487 Q488 F490 F495 H498 H503	C88-M90 VanDerWaalsContact C-N 3.34Å; C88-C486 HydrophobicContact CB-CB 3.88Å; C88-G487 PolarHBondContact O-N 3.07Å; C88-Q488 PolarHBondContact N-O 3.19Å; C88-F490 HydrophobicContact CB-CD2 4.34Å; C88-F490 HydrophobicContact CB-CE2 3.99Å; C88-F495 HydrophobicContact CB-CE2 4.14Å; C88-H498 PolarHBondContact SG-NE2 3.12Å; C88-H503 PolarHBondContact SG-NE2 2.82Å; C88-H503 VanDerWaalsContact SG-NE2 3.38Å
89	T	92.6	Very high	88.5	Confident	85 Å²	85	44.6 Å²	44.6	52%	0.521	23%	0.233	S	C	.	.			trans	-95	18	-179	61.2	0	0	0	0	113.4	C87 R473	C87-T89 PolarHBondContact O-N 3.09Å; T89-R473 PolarHBondContact O-NH2 2.91Å
90	M	90.9	Very high	86.8	Confident	60 Å²	60	43 Å²	43	30%	0.296	24%	0.24	S	C	.	.			trans	-70.8	139.2	178	-83.5	-52.3	-56.2	0	0	111.9	C88 V485 C486 F499 H503	C88-M90 VanDerWaalsContact C-N 3.34Å; M90-V485 CarbonylContact O-C 3.56Å; M90-V485 WeakPolarHBondContact O-CA 3.28Å; M90-C486 PolarHBondContact O-N 3.3Å; M90-F499 HydrophobicContact CG-CD2 3.9Å; M90-F499 HydrophobicContact CG-CE2 3.66Å; M90-F499 HydrophobicContact SD-CD2 4.47Å; M90-F499 HydrophobicContact SD-CE2 3.65Å; M90-F499 HydrophobicContact SD-CZ 4.49Å; M90-H503 HydrophobicContact CG-CB 4.41Å
91	E	90	Very high	85.5	Confident	42 Å²	42	43.3 Å²	43.3	20%	0.196	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	149.4	179.6	-80.8	167.8	-128.7	0	0	111.4	R473 K477 T483 F484 V485	E91-R473 IonicContact OE1-CZ 3.36Å; E91-R473 IonicContact OE1-NE 2.87Å; E91-R473 PolarHBondContact OE1-NE 3.31Å; E91-R473 IonicContact OE1-NH2 2.96Å; E91-R473 PolarHBondContact OE1-NH2 3.27Å; E91-K477 IonicContact OE2-NZ 3.28Å; E91-K477 PolarHBondContact OE2-NZ 3.4Å; E91-T483 HydrophobicContact CB-CG2 4.25Å; E91-T483 HydrophobicContact CG-CG2 3.84Å; E91-T483 WeakPolarHBondContact OE2-CG2 3.4Å; E91-F484 WeakPolarHBondContact CA-O 3.36Å; E91-V485 HydrophobicContact CG-CG2 3.91Å
92	W	89.8	Confident	84.1	Confident	13 Å²	13	45 Å²	45	5%	0.049	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	167	160.9	59.1	99.1	0	0	0	109.1	L122 D126 L468 F484 C486 H503 H507	W92-L122 HydrophobicContact CZ2-CD1 4.41Å; W92-D126 WeakPolarHBondContact CZ2-OD1 3.46Å; W92-D126 PolarHBondContact NE1-OD1 3.08Å; W92-D126 PolarHBondContact NE1-OD2 3.12Å; W92-L468 HydrophobicContact CB-CD2 4.09Å; W92-L468 HydrophobicContact CG-CD2 3.92Å; W92-F484 HydrophobicContact CD2-CB 4.16Å; W92-F484 HydrophobicContact CG-CB 4.46Å; W92-F484 HydrophobicContact CZ2-CB 3.92Å; W92-F484 PolarHBondContact N-O 3.13Å; W92-F484 VanDerWaalsContact N-O 3.12Å; W92-F484 PolarHBondContact O-N 3.2Å; W92-C486 HydrophobicContact CH2-CB 4.32Å; W92-C486 HydrophobicContact CZ3-CB 3.93Å; W92-H503 AromaticContact CZ3-CE1 3.8Å; W92-H507 AromaticContact CD2-CE1 3.82Å; W92-H507 AromaticContact CE3-CE1 3.62Å; W92-H507 AromaticContact CE3-ND1 3.88Å; W92-H507 AromaticContact CH2-CE1 3.97Å; W92-H507 AromaticContact CZ3-CE1 3.71Å
93	N	87.1	Confident	82.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.5	-176.2	-42.8	-91.7	0	0	0	109.7	E469 V471 K477 M481 F482 T483	N93-E469 HydrophobicContact CB-CB 4.38Å; N93-E469 WeakPolarHBondContact CB-O 3.46Å; N93-E469 PolarHBondContact N-O 2.88Å; N93-E469 PolarHBondContact ND2-O 3.14Å; N93-E469 PolarHBondContact O-N 3.33Å; N93-V471 PolarHBondContact ND2-N 3.04Å; N93-K477 WeakPolarHBondContact OD1-CD 3.37Å; N93-K477 WeakPolarHBondContact OD1-CE 3.17Å; N93-K477 PolarHBondContact OD1-NZ 3.06Å; N93-M481 HydrophobicContact CB-CE 3.62Å; N93-F482 CarbonylContact C-O 3.5Å; N93-F482 WeakPolarHBondContact CA-O 3.37Å; N93-T483 PolarHBondContact OD1-OG1 3.27Å; N93-T483 VanDerWaalsContact OD1-OG1 3.1Å
94	R	87.5	Confident	81.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150.3	171.4	-63.2	-174.8	-176.9	-80.2	-2.9	111	D126 L464 E465 L466 F482 F484	R94-D126 IonicContact CZ-OD2 2.99Å; R94-D126 VanDerWaalsContact CZ-OD2 3.28Å; R94-D126 IonicContact NE-OD2 3.94Å; R94-D126 PolarHBondContact NE-OD2 3.42Å; R94-D126 IonicContact NH2-OD2 3.76Å; R94-D126 PolarHBondContact NH2-OD2 2.81Å; R94-L464 HydrophobicContact CB-CB 4.3Å; R94-E465 WeakPolarHBondContact CD-O 3.33Å; R94-E465 PolarHBondContact NH1-O 3.48Å; R94-L466 PolarHBondContact NH1-O 3.33Å; R94-F482 PolarHBondContact N-O 3.47Å; R94-F482 PolarHBondContact O-N 3.34Å; R94-F484 HydrophobicContact CB-CE2 4.14Å; R94-F484 HydrophobicContact CG-CD2 4.44Å; R94-F484 HydrophobicContact CG-CE2 4.2Å
95	W	82.6	Confident	80.1	Confident	52 Å²	52	53.4 Å²	53.4	20%	0.197	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-85.2	153.5	166	-61.3	103.1	0	0	0	111.2	L464 E465 E469 Q478 S480 M481	W95-L464 WeakPolarHBondContact O-CA 3.46Å; W95-E465 HydrophobicContact CB-CG 4.08Å; W95-E465 PolarHBondContact O-N 2.94Å; W95-E469 PolarHBondContact NE1-OE1 2.84Å; W95-Q478 HydrophobicContact CH2-CB 3.43Å; W95-Q478 VanDerWaalsContact CH2-CB 3.43Å; W95-Q478 HydrophobicContact CH2-CG 4.09Å; W95-Q478 HydrophobicContact CZ2-CB 4.33Å; W95-Q478 HydrophobicContact CZ3-CB 4.02Å; W95-S480 WeakPolarHBondContact CZ3-OG 3.31Å; W95-M481 HydrophobicContact CD2-CE 4.41Å; W95-M481 HydrophobicContact CD2-CG 3.78Å; W95-M481 HydrophobicContact CE3-CG 3.63Å; W95-M481 HydrophobicContact CH2-CG 3.61Å; W95-M481 HydrophobicContact CH2-SD 4.07Å; W95-M481 HydrophobicContact CZ2-CE 4.03Å; W95-M481 HydrophobicContact CZ2-CG 3.7Å; W95-M481 HydrophobicContact CZ2-SD 3.75Å; W95-M481 HydrophobicContact CZ3-CG 3.55Å
96	P	80.7	Confident	79	Confident	42 Å²	42	53.9 Å²	53.9	27%	0.273	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-66	141.6	160.1	29.3	-34.1	0	0	0	110	S98 L462 R463 S480 F482	P96-S98 PolarHBondContact O-N 2.8Å; P96-L462 HydrophobicContact CB-CD1 4.14Å; P96-R463 CarbonylContact C-O 3.57Å; P96-R463 VanDerWaalsContact CA-O 3.32Å; P96-R463 WeakPolarHBondContact CA-O 3.37Å; P96-S480 WeakPolarHBondContact CD-O 3.16Å; P96-F482 HydrophobicContact CB-CE2 4.33Å; P96-F482 HydrophobicContact CG-CE2 4.49Å
97	V	72.6	Confident	77.7	Confident	23 Å²	23	56 Å²	56	14%	0.139	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-64.7	132.6	175.8	179.9	0	0	0	0	109.8	D101 Y105 R463 L464 E465	V97-D101 HydrophobicContact CG1-CB 3.93Å; V97-Y105 HydrophobicContact CG2-CD2 3.7Å; V97-Y105 HydrophobicContact CG2-CE2 4.01Å; V97-Y105 HydrophobicContact CG2-CG 4.3Å; V97-R463 HydrophobicContact CB-CB 3.95Å; V97-R463 HydrophobicContact CG2-CB 3.64Å; V97-R463 PolarHBondContact N-O 2.81Å; V97-L464 VanDerWaalsContact CG2-C 3.46Å; V97-E465 HydrophobicContact CG2-CG 4.24Å
98	S	68.3	Low	76.4	Confident	59 Å²	59	53.7 Å²	53.7	41%	0.413	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-58.8	146.8	173.9	175.5	0	0	0	0	112.2	P96 A100 D101 H102	P96-S98 PolarHBondContact O-N 2.8Å; S98-A100 PolarHBondContact O-N 2.72Å; S98-A100 VanDerWaalsContact O-N 3.17Å; S98-A100 PolarHBondContact OG-N 3.35Å; S98-D101 WeakPolarHBondContact CB-OD2 3.39Å; S98-D101 PolarHBondContact O-N 2.69Å; S98-H102 PolarHBondContact O-N 2.88Å; S98-H102 VanDerWaalsContact O-N 3.15Å
99	Y	61.9	Low	75	Confident	216 Å²	216	55.7 Å²	55.7	85%	0.847	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-32	175	-173.7	-94.4	0	0	0	112.8	D101	Y99-D101 VanDerWaalsContact C-N 3.34Å; Y99-D101 PolarHBondContact O-N 2.7Å
100	A	59.2	Low	73.5	Confident	83 Å²	83	58 Å²	58	69%	0.686	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-37.3	177.1	0	0	0	0	0	112.7	S98	S98-A100 PolarHBondContact O-N 2.72Å; S98-A100 VanDerWaalsContact O-N 3.17Å; S98-A100 PolarHBondContact OG-N 3.35Å
101	D	66	Low	71.6	Confident	75 Å²	75	59.2 Å²	59.2	40%	0.401	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-10.5	-173.8	-58.9	-58.1	0	0	0	112.8	V97 S98 Y99 K103 S104 Y105	V97-D101 HydrophobicContact CG1-CB 3.93Å; S98-D101 WeakPolarHBondContact CB-OD2 3.39Å; S98-D101 PolarHBondContact O-N 2.69Å; Y99-D101 VanDerWaalsContact C-N 3.34Å; Y99-D101 PolarHBondContact O-N 2.7Å; D101-K103 VanDerWaalsContact C-N 3.32Å; D101-K103 PolarHBondContact O-N 2.8Å; D101-S104 WeakPolarHBondContact O-CA 3.36Å; D101-S104 WeakPolarHBondContact O-CB 3.46Å; D101-S104 PolarHBondContact O-N 3.5Å; D101-S104 PolarHBondContact O-OG 2.84Å; D101-Y105 PolarHBondContact O-N 3.3Å
102	H	67.8	Low	69.7	Low	35 Å²	35	62.1 Å²	62.1	16%	0.162	31%	0.314	C	S	.	.	H	α-helix	trans	-51.9	-44.2	-176	-165.5	-82.1	0	0	0	113.2	S98 S104 Y105 E106 T461	S98-H102 PolarHBondContact O-N 2.88Å; S98-H102 VanDerWaalsContact O-N 3.15Å; H102-S104 VanDerWaalsContact C-N 3.33Å; H102-S104 PolarHBondContact O-N 3.18Å; H102-Y105 PolarHBondContact O-N 3.11Å; H102-E106 IonicContact CE1-OE1 3.8Å; H102-E106 PolarHBondContact CE1-OE1 3.49Å; H102-E106 IonicContact ND1-OE1 2.71Å; H102-E106 PolarHBondContact O-N 2.96Å; H102-T461 PolarHBondContact NE2-O 3.27Å
103	K	66.8	Low	67.6	Low	166 Å²	166	69.8 Å²	69.8	72%	0.722	36%	0.356	S	S	*	.	H	α-helix	trans	-63	-35.8	175.7	-69.7	-175.6	178.9	-179.8	0	113.4	D101 N107	D101-K103 VanDerWaalsContact C-N 3.32Å; D101-K103 PolarHBondContact O-N 2.8Å; K103-N107 VanDerWaalsContact O-CG 3.24Å; K103-N107 PolarHBondContact O-N 3.19Å; K103-N107 PolarHBondContact O-ND2 3.32Å
104	S	67.1	Low	65.9	Low	23 Å²	23	77.5 Å²	77.5	16%	0.161	39%	0.392	C	S	.	.	H	α-helix	trans	-70.9	-40.9	176.9	77.4	0	0	0	0	110.7	D101 H102 N107 L108	D101-S104 WeakPolarHBondContact O-CA 3.36Å; D101-S104 WeakPolarHBondContact O-CB 3.46Å; D101-S104 PolarHBondContact O-N 3.5Å; D101-S104 PolarHBondContact O-OG 2.84Å; H102-S104 VanDerWaalsContact C-N 3.33Å; H102-S104 PolarHBondContact O-N 3.18Å; S104-N107 PolarHBondContact O-N 2.71Å; S104-L108 WeakPolarHBondContact O-CG 3.2Å; S104-L108 PolarHBondContact O-N 2.83Å; S104-L108 VanDerWaalsContact O-N 3.11Å
105	Y	71.2	Confident	64.3	Low	10 Å²	10	80.5 Å²	80.5	4%	0.039	41%	0.41	C	S	.	.	H	α-helix	trans	-63.5	-43.2	174.5	-164.9	-76.2	0	0	0	111.8	V97 D101 H102 N107 L108 S109 M120 R463 L464 L466	V97-Y105 HydrophobicContact CG2-CD2 3.7Å; V97-Y105 HydrophobicContact CG2-CE2 4.01Å; V97-Y105 HydrophobicContact CG2-CG 4.3Å; D101-Y105 PolarHBondContact O-N 3.3Å; H102-Y105 PolarHBondContact O-N 3.11Å; Y105-N107 VanDerWaalsContact C-N 3.34Å; Y105-N107 PolarHBondContact O-N 2.92Å; Y105-L108 WeakPolarHBondContact O-CB 3.49Å; Y105-L108 PolarHBondContact O-N 3.45Å; Y105-L108 VanDerWaalsContact O-N 3.15Å; Y105-S109 WeakPolarHBondContact O-CB 3.44Å; Y105-S109 PolarHBondContact O-N 3.09Å; Y105-S109 VanDerWaalsContact O-N 3.09Å; Y105-S109 PolarHBondContact O-OG 2.82Å; Y105-M120 HydrophobicContact CE1-CE 4.34Å; Y105-M120 HydrophobicContact CE1-SD 4.36Å; Y105-M120 HydrophobicContact CE2-CE 4.3Å; Y105-R463 HydrophobicContact CD1-CB 4.06Å; Y105-R463 HydrophobicContact CD1-CG 3.82Å; Y105-R463 HydrophobicContact CE1-CB 4.06Å; Y105-R463 HydrophobicContact CE1-CG 4.01Å; Y105-R463 HydrophobicContact CG-CB 4.37Å; Y105-R463 HydrophobicContact CG-CG 4.44Å; Y105-L464 WeakPolarHBondContact CE2-O 3.11Å; Y105-L466 HydrophobicContact CE2-CD2 3.87Å; Y105-L466 HydrophobicContact CE2-CG 4.29Å
106	E	70.5	Confident	63.6	Low	55 Å²	55	82.6 Å²	82.6	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-57.8	-47	176.3	-80.4	-158.4	161.7	0	0	111.6	H102 L108 S109 K110	H102-E106 IonicContact CE1-OE1 3.8Å; H102-E106 PolarHBondContact CE1-OE1 3.49Å; H102-E106 IonicContact ND1-OE1 2.71Å; H102-E106 PolarHBondContact O-N 2.96Å; E106-L108 VanDerWaalsContact C-N 3.29Å; E106-L108 PolarHBondContact O-N 2.75Å; E106-S109 WeakPolarHBondContact CA-OG 3.16Å; E106-S109 CarbonylContact O-C 3.48Å; E106-S109 WeakPolarHBondContact O-CA 3.23Å; E106-S109 PolarHBondContact O-N 2.97Å; E106-S109 PolarHBondContact O-OG 3.22Å; E106-K110 HydrophobicContact CB-CD 4.42Å; E106-K110 WeakPolarHBondContact O-CB 3.45Å; E106-K110 VanDerWaalsContact O-CG 3.29Å; E106-K110 WeakPolarHBondContact O-CG 3.44Å; E106-K110 PolarHBondContact O-N 3.21Å; E106-K110 WeakPolarHBondContact OE2-CE 3.48Å; E106-K110 IonicContact OE2-NZ 3.6Å; E106-K110 PolarHBondContact OE2-NZ 3.15Å
107	N	69	Low	63.8	Low	76 Å²	76	81.3 Å²	81.3	41%	0.406	41%	0.413	S	S	.	.	H	α-helix	trans	-61.5	-36.7	177	-65.6	-18.1	0	0	0	112.4	K103 S104 Y105 S109	K103-N107 VanDerWaalsContact O-CG 3.24Å; K103-N107 PolarHBondContact O-N 3.19Å; K103-N107 PolarHBondContact O-ND2 3.32Å; S104-N107 PolarHBondContact O-N 2.71Å; Y105-N107 VanDerWaalsContact C-N 3.34Å; Y105-N107 PolarHBondContact O-N 2.92Å; N107-S109 PolarHBondContact O-N 3.49Å
108	L	67.4	Low	64.6	Low	12 Å²	12	80.3 Å²	80.3	6%	0.063	41%	0.407	C	S	.	.	H	α-helix	trans	-69	-14.8	173.5	-67.2	169.2	0	0	0	113.8	S104 Y105 E106 M120 T526	S104-L108 WeakPolarHBondContact O-CG 3.2Å; S104-L108 PolarHBondContact O-N 2.83Å; S104-L108 VanDerWaalsContact O-N 3.11Å; Y105-L108 WeakPolarHBondContact O-CB 3.49Å; Y105-L108 PolarHBondContact O-N 3.45Å; Y105-L108 VanDerWaalsContact O-N 3.15Å; E106-L108 VanDerWaalsContact C-N 3.29Å; E106-L108 PolarHBondContact O-N 2.75Å; L108-M120 HydrophobicContact CB-CE 3.72Å; L108-T526 HydrophobicContact CD2-CG2 4.14Å
109	S	66.4	Low	65.6	Low	41 Å²	41	77.8 Å²	77.8	29%	0.287	39%	0.389	S	S	.	.	H	α-helix	trans	-113.8	-8.7	-175.4	69.6	0	0	0	0	115.1	Y105 E106 N107 D111	Y105-S109 WeakPolarHBondContact O-CB 3.44Å; Y105-S109 PolarHBondContact O-N 3.09Å; Y105-S109 VanDerWaalsContact O-N 3.09Å; Y105-S109 PolarHBondContact O-OG 2.82Å; E106-S109 WeakPolarHBondContact CA-OG 3.16Å; E106-S109 CarbonylContact O-C 3.48Å; E106-S109 WeakPolarHBondContact O-CA 3.23Å; E106-S109 PolarHBondContact O-N 2.97Å; E106-S109 PolarHBondContact O-OG 3.22Å; N107-S109 PolarHBondContact O-N 3.49Å; S109-D111 CarbonylContact C-O 3.53Å
110	K	60.1	Low	66.8	Low	135 Å²	135	67.8 Å²	67.8	59%	0.587	35%	0.349	S	S	*	.	H	α-helix	trans	-92.2	-29.6	-178.8	-80.3	171.4	-176.2	168.6	0	113.1	E106	E106-K110 HydrophobicContact CB-CD 4.42Å; E106-K110 WeakPolarHBondContact O-CB 3.45Å; E106-K110 VanDerWaalsContact O-CG 3.29Å; E106-K110 WeakPolarHBondContact O-CG 3.44Å; E106-K110 PolarHBondContact O-N 3.21Å; E106-K110 WeakPolarHBondContact OE2-CE 3.48Å; E106-K110 IonicContact OE2-NZ 3.6Å; E106-K110 PolarHBondContact OE2-NZ 3.15Å
111	D	51.1	Low	68.2	Low	84 Å²	84	64 Å²	64	45%	0.449	32%	0.318	S	S	.	.	S	Bend	trans	-72.8	152.9	159.3	-63.8	-22.9	0	0	0	108.3	S109 T526	S109-D111 CarbonylContact C-O 3.53Å; D111-T526 WeakPolarHBondContact OD2-CG2 3.48Å
112	F	51.6	Low	69.3	Low	103 Å²	103	60.6 Å²	60.6	45%	0.452	30%	0.3	S	S	.	.			trans	87	99	168.9	-42.9	-66.5	0	0	0	119.5	E114	F112-E114 VanDerWaalsContact C-N 3.28Å
113	D	44.8	Very low	70.3	Confident	175 Å²	175	58.9 Å²	58.9	94%	0.936	29%	0.292	S	S	*	.	S	Bend	trans	-71.4	-22.5	151.3	-72.2	-54.8	0	0	0	112.4
114	E	52.3	Low	71.2	Confident	163 Å²	163	52.9 Å²	52.9	76%	0.762	27%	0.268	S	S	*	.	S	Bend	trans	-115.9	89.4	179.6	-63.6	-172.4	163.3	0	0	111.2	F112 E116	F112-E114 VanDerWaalsContact C-N 3.28Å; E114-E116 PolarHBondContact O-N 3.43Å
115	V	54.2	Low	72.2	Confident	62 Å²	62	53.3 Å²	53.3	38%	0.376	27%	0.267	S	S	.	.			trans	-70.9	89.2	-174.9	-173.1	0	0	0	0	112	M120 A121 L124	V115-M120 HydrophobicContact CG1-CG 4.29Å; V115-A121 HydrophobicContact CG1-CB 3.99Å; V115-L124 HydrophobicContact CG2-CD1 4.46Å
116	E	67.1	Low	73.2	Confident	97 Å²	97	52.9 Å²	52.9	45%	0.453	27%	0.265	S	S	.	.			trans	-76.2	-17.2	176.2	-91.9	-129.9	173.3	0	0	113.8	E114 R530 R540	E114-E116 PolarHBondContact O-N 3.43Å; E116-R530 PolarHBondContact O-NE 2.98Å; E116-R530 PolarHBondContact O-NH2 2.9Å; E116-R530 IonicContact OE2-CZ 2.78Å; E116-R530 IonicContact OE2-NH1 3.58Å; E116-R530 IonicContact OE2-NH2 3.55Å; E116-R530 PolarHBondContact OE2-NH2 2.65Å; E116-R540 IonicContact OE1-CZ 3.81Å; E116-R540 IonicContact OE1-NH1 3.47Å; E116-R540 PolarHBondContact OE1-NH1 3.11Å; E116-R540 IonicContact OE1-NH2 3.56Å; E116-R540 PolarHBondContact OE1-NH2 3.35Å; E116-R540 IonicContact OE2-NH1 2.87Å
117	Q	85.8	Confident	73.9	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.065	26%	0.256	C	S	.	.			trans	-89.1	121.6	-173.6	-62.8	-176.4	-17.5	0	0	112.5	D119 M120 A121 R517 T526 S528	Q117-D119 PolarHBondContact O-N 3.38Å; Q117-M120 HydrophobicContact CB-CB 4.14Å; Q117-M120 PolarHBondContact O-N 3.11Å; Q117-A121 WeakPolarHBondContact O-CB 3.49Å; Q117-A121 PolarHBondContact O-N 3.38Å; Q117-R517 VanDerWaalsContact OE1-CZ 3.23Å; Q117-T526 PolarHBondContact NE2-O 3.2Å; Q117-S528 WeakPolarHBondContact CG-OG 3.49Å; Q117-S528 PolarHBondContact NE2-OG 2.65Å
118	L	89.3	Confident	74.6	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-38.1	-168	-63.9	176.2	0	0	0	114.4	L122 L510 M514 E515 I541 H543 F550	L118-L122 PolarHBondContact O-N 2.85Å; L118-L510 HydrophobicContact CB-CD2 3.64Å; L118-M514 HydrophobicContact CD1-SD 4.36Å; L118-E515 PolarHBondContact N-OE2 3.41Å; L118-I541 HydrophobicContact CD1-CB 3.96Å; L118-I541 HydrophobicContact CD1-CG2 3.87Å; L118-I541 HydrophobicContact CD2-CG2 4.07Å; L118-H543 HydrophobicContact CD2-CB 4.21Å; L118-F550 HydrophobicContact CB-CE1 4.42Å; L118-F550 HydrophobicContact CD2-CD1 4.26Å; L118-F550 HydrophobicContact CD2-CE1 4.17Å
119	D	88.9	Confident	75.6	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.032	26%	0.263	C	S	.	.	H	α-helix	trans	-69	-42.4	178.9	59.9	-17.6	0	0	0	111.8	Q117 A123 L466 L510 R517	Q117-D119 PolarHBondContact O-N 3.38Å; D119-A123 WeakPolarHBondContact O-CB 3.28Å; D119-A123 PolarHBondContact O-N 2.9Å; D119-L466 HydrophobicContact CB-CB 4.44Å; D119-L510 HydrophobicContact CB-CB 4.49Å; D119-L510 HydrophobicContact CB-CD2 4.24Å; D119-R517 VanDerWaalsContact CG-NH2 3.31Å; D119-R517 IonicContact OD1-CZ 3.38Å; D119-R517 IonicContact OD1-NE 2.75Å; D119-R517 IonicContact OD1-NH2 3.19Å; D119-R517 PolarHBondContact OD1-NH2 3.39Å; D119-R517 IonicContact OD2-CZ 3.5Å; D119-R517 IonicContact OD2-NE 3.37Å; D119-R517 PolarHBondContact OD2-NE 3.36Å; D119-R517 IonicContact OD2-NH2 3.6Å; D119-R517 PolarHBondContact OD2-NH2 3.41Å
120	M	86.4	Confident	76.4	Confident	5 Å²	5	52 Å²	52	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-44.2	173.3	-178	59.8	77.7	0	0	111.7	Y105 L108 V115 Q117 L122 A123 L124 L466	Y105-M120 HydrophobicContact CE1-CE 4.34Å; Y105-M120 HydrophobicContact CE1-SD 4.36Å; Y105-M120 HydrophobicContact CE2-CE 4.3Å; L108-M120 HydrophobicContact CB-CE 3.72Å; V115-M120 HydrophobicContact CG1-CG 4.29Å; Q117-M120 HydrophobicContact CB-CB 4.14Å; Q117-M120 PolarHBondContact O-N 3.11Å; M120-L122 VanDerWaalsContact C-N 3.29Å; M120-L122 PolarHBondContact O-N 2.82Å; M120-A123 PolarHBondContact O-N 3.25Å; M120-L124 HydrophobicContact CG-CD1 3.87Å; M120-L124 HydrophobicContact CG-CG 4.27Å; M120-L124 WeakPolarHBondContact O-CB 3.46Å; M120-L124 VanDerWaalsContact O-CG 3.28Å; M120-L124 WeakPolarHBondContact O-CG 3.42Å; M120-L124 PolarHBondContact O-N 3.46Å; M120-L124 HydrophobicContact SD-CD1 4Å; M120-L124 HydrophobicContact SD-CD2 4.33Å; M120-L124 HydrophobicContact SD-CG 3.88Å; M120-L466 HydrophobicContact CB-CD2 4.35Å; M120-L466 HydrophobicContact CE-CD1 4.38Å; M120-L466 HydrophobicContact CE-CD2 3.93Å; M120-L466 HydrophobicContact SD-CD2 3.99Å
121	A	87.8	Confident	77.4	Confident	4 Å²	4	47 Å²	47	3%	0.033	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-42.8	177.9	0	0	0	0	0	112.1	V115 Q117 Q125 H543	V115-A121 HydrophobicContact CG1-CB 3.99Å; Q117-A121 WeakPolarHBondContact O-CB 3.49Å; Q117-A121 PolarHBondContact O-N 3.38Å; A121-Q125 PolarHBondContact O-N 3.21Å; A121-Q125 VanDerWaalsContact O-N 3.1Å; A121-H543 HydrophobicContact CB-CB 3.84Å
122	L	90.5	Very high	78.8	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-72.4	-41.8	176.8	-171	63.3	0	0	0	112.4	W92 L118 M120 L124 Q125 D126 L468 L510 F550	W92-L122 HydrophobicContact CZ2-CD1 4.41Å; L118-L122 PolarHBondContact O-N 2.85Å; M120-L122 VanDerWaalsContact C-N 3.29Å; M120-L122 PolarHBondContact O-N 2.82Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 2.85Å; L122-Q125 WeakPolarHBondContact O-CB 3.4Å; L122-Q125 PolarHBondContact O-N 2.82Å; L122-Q125 VanDerWaalsContact O-N 3.12Å; L122-D126 VanDerWaalsContact O-CG 3.27Å; L122-D126 PolarHBondContact O-N 2.91Å; L122-L468 HydrophobicContact CD2-CD1 4.3Å; L122-L468 HydrophobicContact CD2-CD2 3.94Å; L122-L510 HydrophobicContact CD2-CD1 3.87Å; L122-F550 HydrophobicContact CB-CZ 4.33Å; L122-F550 HydrophobicContact CD1-CE2 4.41Å; L122-F550 HydrophobicContact CD1-CZ 4.38Å; L122-F550 HydrophobicContact CD2-CE2 4.45Å; L122-F550 HydrophobicContact CD2-CZ 4.16Å
123	A	88.5	Confident	80	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-39.1	175.9	0	0	0	0	0	112.4	D119 M120 D126 Q127 L466	D119-A123 WeakPolarHBondContact O-CB 3.28Å; D119-A123 PolarHBondContact O-N 2.9Å; M120-A123 PolarHBondContact O-N 3.25Å; A123-D126 PolarHBondContact O-N 3.29Å; A123-Q127 WeakPolarHBondContact O-CB 3.32Å; A123-Q127 PolarHBondContact O-N 2.91Å; A123-L466 HydrophobicContact CB-CD2 3.63Å
124	L	85.7	Confident	81.2	Confident	39 Å²	39	39.7 Å²	39.7	20%	0.204	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-31.8	173.9	-68.6	172.9	0	0	0	112.7	V115 M120 L122 R128	V115-L124 HydrophobicContact CG2-CD1 4.46Å; M120-L124 HydrophobicContact CG-CD1 3.87Å; M120-L124 HydrophobicContact CG-CG 4.27Å; M120-L124 WeakPolarHBondContact O-CB 3.46Å; M120-L124 VanDerWaalsContact O-CG 3.28Å; M120-L124 WeakPolarHBondContact O-CG 3.42Å; M120-L124 PolarHBondContact O-N 3.46Å; M120-L124 HydrophobicContact SD-CD1 4Å; M120-L124 HydrophobicContact SD-CD2 4.33Å; M120-L124 HydrophobicContact SD-CG 3.88Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 2.85Å; L124-R128 WeakPolarHBondContact O-CG 3.45Å; L124-R128 PolarHBondContact O-N 3.15Å; L124-R128 PolarHBondContact O-NH1 3.34Å; L124-R128 VanDerWaalsContact O-NH1 3.15Å
125	Q	88.6	Confident	82.1	Confident	33 Å²	33	37 Å²	37	15%	0.154	19%	0.185	C	C	.	.	H	α-helix	trans	-65.6	-48.3	171	168.4	161.1	-41	0	0	111.7	A121 L122 Q127 R128 M129 H543 G548	A121-Q125 PolarHBondContact O-N 3.21Å; A121-Q125 VanDerWaalsContact O-N 3.1Å; L122-Q125 WeakPolarHBondContact O-CB 3.4Å; L122-Q125 PolarHBondContact O-N 2.82Å; L122-Q125 VanDerWaalsContact O-N 3.12Å; Q125-Q127 VanDerWaalsContact C-N 3.3Å; Q125-Q127 PolarHBondContact O-N 2.86Å; Q125-R128 VanDerWaalsContact CA-NH2 3.35Å; Q125-R128 WeakPolarHBondContact O-CB 3.34Å; Q125-R128 PolarHBondContact O-N 2.95Å; Q125-R128 VanDerWaalsContact O-N 3.13Å; Q125-M129 PolarHBondContact O-N 3.04Å; Q125-H543 PolarHBondContact OE1-NE2 2.9Å; Q125-G548 PolarHBondContact NE2-O 2.9Å; Q125-G548 PolarHBondContact OE1-O 2.97Å
126	D	90.4	Very high	82.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-38.9	178.4	-65	-26.5	0	0	0	110.7	W92 R94 L122 A123 R128 M129 L130 L464 F484	W92-D126 WeakPolarHBondContact CZ2-OD1 3.46Å; W92-D126 PolarHBondContact NE1-OD1 3.08Å; W92-D126 PolarHBondContact NE1-OD2 3.12Å; R94-D126 IonicContact CZ-OD2 2.99Å; R94-D126 VanDerWaalsContact CZ-OD2 3.28Å; R94-D126 IonicContact NE-OD2 3.94Å; R94-D126 PolarHBondContact NE-OD2 3.42Å; R94-D126 IonicContact NH2-OD2 3.76Å; R94-D126 PolarHBondContact NH2-OD2 2.81Å; L122-D126 VanDerWaalsContact O-CG 3.27Å; L122-D126 PolarHBondContact O-N 2.91Å; A123-D126 PolarHBondContact O-N 3.29Å; D126-R128 PolarHBondContact O-N 3.12Å; D126-M129 PolarHBondContact O-N 3.35Å; D126-L130 WeakPolarHBondContact O-CB 3.45Å; D126-L130 PolarHBondContact O-N 2.75Å; D126-L464 HydrophobicContact CB-CD1 3.9Å; D126-F484 HydrophobicContact CB-CD1 3.85Å; D126-F484 HydrophobicContact CB-CD2 4.04Å; D126-F484 HydrophobicContact CB-CE1 3.79Å; D126-F484 HydrophobicContact CB-CE2 3.98Å; D126-F484 HydrophobicContact CB-CG 3.99Å; D126-F484 HydrophobicContact CB-CZ 3.86Å; D126-F484 WeakPolarHBondContact O-CE1 3.46Å
127	Q	85.9	Confident	81.9	Confident	13 Å²	13	38.4 Å²	38.4	6%	0.061	20%	0.2	C	C	.	.	H	α-helix	trans	-61.4	-43.1	172.6	175.4	163.5	-5	0	0	112	A123 Q125 L130 L131 L462 R463 L464	A123-Q127 WeakPolarHBondContact O-CB 3.32Å; A123-Q127 PolarHBondContact O-N 2.91Å; Q125-Q127 VanDerWaalsContact C-N 3.3Å; Q125-Q127 PolarHBondContact O-N 2.86Å; Q127-L130 PolarHBondContact O-N 3.47Å; Q127-L131 HydrophobicContact CG-CD1 4.19Å; Q127-L131 HydrophobicContact CG-CG 4.45Å; Q127-L131 WeakPolarHBondContact O-CG 3.41Å; Q127-L131 PolarHBondContact O-N 3.25Å; Q127-L462 VanDerWaalsContact CD-O 3.32Å; Q127-L462 PolarHBondContact NE2-O 3.35Å; Q127-R463 VanDerWaalsContact NE2-NH1 3.12Å; Q127-L464 HydrophobicContact CB-CD1 4.14Å; Q127-L464 HydrophobicContact CB-CG 4.42Å
128	R	84.8	Confident	80.4	Confident	69 Å²	69	39.7 Å²	39.7	26%	0.26	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-45.6	174.8	-73.9	-176.2	-60.2	-87.6	4.1	111.5	L124 Q125 D126 L130 L131 E132	L124-R128 WeakPolarHBondContact O-CG 3.45Å; L124-R128 PolarHBondContact O-N 3.15Å; L124-R128 PolarHBondContact O-NH1 3.34Å; L124-R128 VanDerWaalsContact O-NH1 3.15Å; Q125-R128 VanDerWaalsContact CA-NH2 3.35Å; Q125-R128 WeakPolarHBondContact O-CB 3.34Å; Q125-R128 PolarHBondContact O-N 2.95Å; Q125-R128 VanDerWaalsContact O-N 3.13Å; D126-R128 PolarHBondContact O-N 3.12Å; R128-L130 VanDerWaalsContact C-N 3.33Å; R128-L130 PolarHBondContact O-N 3.47Å; R128-L131 PolarHBondContact O-N 2.79Å; R128-E132 WeakPolarHBondContact O-CB 3.38Å; R128-E132 WeakPolarHBondContact O-CG 3.28Å; R128-E132 PolarHBondContact O-N 3.26Å
129	M	86.7	Confident	78.4	Confident	71 Å²	71	44.4 Å²	44.4	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-59.8	-42.2	178.4	-169.2	-171.4	-60	0	0	112	Q125 D126 E132 S133 F484	Q125-M129 PolarHBondContact O-N 3.04Å; D126-M129 PolarHBondContact O-N 3.35Å; M129-E132 PolarHBondContact O-N 3.02Å; M129-S133 PolarHBondContact O-N 2.85Å; M129-F484 HydrophobicContact CB-CD1 4.44Å; M129-F484 HydrophobicContact SD-CD1 3.88Å
130	L	84.6	Confident	76.4	Confident	14 Å²	14	49 Å²	49	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-46.2	176.3	-179.1	57.3	0	0	0	112	D126 Q127 R128 E132 S133 L134 L462 L464 F482 F484	D126-L130 WeakPolarHBondContact O-CB 3.45Å; D126-L130 PolarHBondContact O-N 2.75Å; Q127-L130 PolarHBondContact O-N 3.47Å; R128-L130 VanDerWaalsContact C-N 3.33Å; R128-L130 PolarHBondContact O-N 3.47Å; L130-E132 VanDerWaalsContact C-N 3.32Å; L130-E132 PolarHBondContact O-N 2.98Å; L130-S133 PolarHBondContact O-N 3.45Å; L130-S133 PolarHBondContact O-OG 3Å; L130-L134 HydrophobicContact CD1-CD1 4.31Å; L130-L134 HydrophobicContact CD1-CG 4.39Å; L130-L134 HydrophobicContact CG-CD1 4.25Å; L130-L134 WeakPolarHBondContact O-CG 3.38Å; L130-L134 PolarHBondContact O-N 2.91Å; L130-L134 VanDerWaalsContact O-N 3.08Å; L130-L462 HydrophobicContact CD2-CD2 3.77Å; L130-L462 HydrophobicContact CG-CD2 4.49Å; L130-L464 HydrophobicContact CD2-CD1 4.46Å; L130-L464 HydrophobicContact CD2-CD2 4.02Å; L130-F482 HydrophobicContact CD1-CD1 3.54Å; L130-F482 HydrophobicContact CD1-CE1 3.81Å; L130-F482 HydrophobicContact CD1-CG 4.25Å; L130-F482 HydrophobicContact CD2-CB 4.44Å; L130-F482 HydrophobicContact CD2-CD1 3.7Å; L130-F482 HydrophobicContact CD2-CD2 3.86Å; L130-F482 HydrophobicContact CD2-CE1 3.83Å; L130-F482 HydrophobicContact CD2-CE2 3.99Å; L130-F482 HydrophobicContact CD2-CG 3.71Å; L130-F482 HydrophobicContact CD2-CZ 3.97Å; L130-F482 HydrophobicContact CG-CD1 4.3Å; L130-F482 HydrophobicContact CG-CE1 4.46Å; L130-F484 HydrophobicContact CB-CE1 4.08Å; L130-F484 HydrophobicContact CB-CZ 4.3Å
131	L	80.6	Confident	74.3	Confident	30 Å²	30	52.4 Å²	52.4	16%	0.157	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-32.7	179.1	-66.8	-177.3	0	0	0	112.7	Q127 R128 L134 K135 F459	Q127-L131 HydrophobicContact CG-CD1 4.19Å; Q127-L131 HydrophobicContact CG-CG 4.45Å; Q127-L131 WeakPolarHBondContact O-CG 3.41Å; Q127-L131 PolarHBondContact O-N 3.25Å; R128-L131 PolarHBondContact O-N 2.79Å; L131-L134 HydrophobicContact CD2-CD1 4.46Å; L131-K135 VanDerWaalsContact O-CG 3.28Å; L131-K135 WeakPolarHBondContact O-CG 3.4Å; L131-K135 PolarHBondContact O-N 2.87Å; L131-F459 HydrophobicContact CD1-CB 4.3Å; L131-F459 HydrophobicContact CD2-CB 3.7Å; L131-F459 HydrophobicContact CD2-CD1 3.66Å; L131-F459 HydrophobicContact CD2-CG 3.86Å
132	E	80.6	Confident	72.1	Confident	95 Å²	95	60.1 Å²	60.1	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-40.3	173.7	-74	176	175.9	0	0	111.8	R128 M129 L130 K135 V136 R268	R128-E132 WeakPolarHBondContact O-CB 3.38Å; R128-E132 WeakPolarHBondContact O-CG 3.28Å; R128-E132 PolarHBondContact O-N 3.26Å; M129-E132 PolarHBondContact O-N 3.02Å; L130-E132 VanDerWaalsContact C-N 3.32Å; L130-E132 PolarHBondContact O-N 2.98Å; E132-K135 PolarHBondContact O-N 2.9Å; E132-V136 PolarHBondContact O-N 2.92Å; E132-R268 IonicContact OE1-NH1 2.98Å
133	S	76.3	Confident	69.6	Low	60 Å²	60	67 Å²	67	42%	0.42	36%	0.356	S	S	.	.	H	α-helix	trans	-65.2	-41.7	177	74.8	0	0	0	0	112.4	M129 L130 K135 V136 T137	M129-S133 PolarHBondContact O-N 2.85Å; L130-S133 PolarHBondContact O-N 3.45Å; L130-S133 PolarHBondContact O-OG 3Å; S133-K135 VanDerWaalsContact C-N 3.35Å; S133-K135 PolarHBondContact O-N 2.82Å; S133-V136 PolarHBondContact O-N 3.5Å; S133-T137 PolarHBondContact O-N 3.47Å; S133-T137 PolarHBondContact O-OG1 3.37Å; S133-T137 VanDerWaalsContact O-OG1 3.13Å
134	L	70.8	Confident	67.1	Low	53 Å²	53	69.8 Å²	69.8	28%	0.277	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-40.1	176.9	-70.1	171.2	0	0	0	112.5	L130 L131 V136 T137 T138 F459	L130-L134 HydrophobicContact CD1-CD1 4.31Å; L130-L134 HydrophobicContact CD1-CG 4.39Å; L130-L134 HydrophobicContact CG-CD1 4.25Å; L130-L134 WeakPolarHBondContact O-CG 3.38Å; L130-L134 PolarHBondContact O-N 2.91Å; L130-L134 VanDerWaalsContact O-N 3.08Å; L131-L134 HydrophobicContact CD2-CD1 4.46Å; L134-V136 VanDerWaalsContact C-N 3.32Å; L134-V136 PolarHBondContact O-N 3.17Å; L134-T137 PolarHBondContact O-N 2.88Å; L134-T138 PolarHBondContact O-N 2.92Å; L134-T138 VanDerWaalsContact O-N 3.08Å; L134-T138 PolarHBondContact O-OG1 3.42Å; L134-F459 HydrophobicContact CB-CE1 4.36Å; L134-F459 HydrophobicContact CD1-CE1 4.27Å
135	K	71.1	Confident	64.6	Low	107 Å²	107	76.5 Å²	76.5	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-36.9	176.2	-73.5	168.7	-175.2	178.6	0	113	L131 E132 S133 T138 N139	L131-K135 VanDerWaalsContact O-CG 3.28Å; L131-K135 WeakPolarHBondContact O-CG 3.4Å; L131-K135 PolarHBondContact O-N 2.87Å; E132-K135 PolarHBondContact O-N 2.9Å; S133-K135 VanDerWaalsContact C-N 3.35Å; S133-K135 PolarHBondContact O-N 2.82Å; K135-T138 WeakPolarHBondContact CA-OG1 3.43Å; K135-T138 PolarHBondContact O-OG1 2.95Å; K135-N139 VanDerWaalsContact O-CG 3.27Å; K135-N139 PolarHBondContact O-N 2.86Å; K135-N139 PolarHBondContact O-ND2 2.7Å
136	V	60.9	Low	62.3	Low	95 Å²	95	84.9 Å²	84.9	58%	0.576	45%	0.451	S	S	*	.	H	α-helix	trans	-65	-46.6	176.6	176.2	0	0	0	0	109.9	E132 S133 L134 T138 N139 V140	E132-V136 PolarHBondContact O-N 2.92Å; S133-V136 PolarHBondContact O-N 3.5Å; L134-V136 VanDerWaalsContact C-N 3.32Å; L134-V136 PolarHBondContact O-N 3.17Å; V136-T138 PolarHBondContact O-N 2.93Å; V136-N139 PolarHBondContact O-N 3.42Å; V136-V140 WeakPolarHBondContact O-CG2 3.2Å; V136-V140 PolarHBondContact O-N 3.04Å; V136-V140 VanDerWaalsContact O-N 3.07Å
137	T	56.3	Low	59.3	Low	93 Å²	93	88.6 Å²	88.6	57%	0.571	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-43.4	179.6	-41.6	0	0	0	0	112.3	S133 L134 N139 V140 S141	S133-T137 PolarHBondContact O-N 3.47Å; S133-T137 PolarHBondContact O-OG1 3.37Å; S133-T137 VanDerWaalsContact O-OG1 3.13Å; L134-T137 PolarHBondContact O-N 2.88Å; T137-N139 VanDerWaalsContact C-N 3.31Å; T137-N139 PolarHBondContact O-N 3.01Å; T137-V140 PolarHBondContact O-N 3.19Å; T137-S141 PolarHBondContact O-N 3.34Å
138	T	53.8	Low	56.5	Low	41 Å²	41	92 Å²	92	25%	0.252	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-34.4	177.7	51.3	0	0	0	0	113.1	L134 K135 V136 K142 L388	L134-T138 PolarHBondContact O-N 2.92Å; L134-T138 VanDerWaalsContact O-N 3.08Å; L134-T138 PolarHBondContact O-OG1 3.42Å; K135-T138 WeakPolarHBondContact CA-OG1 3.43Å; K135-T138 PolarHBondContact O-OG1 2.95Å; V136-T138 PolarHBondContact O-N 2.93Å; T138-K142 PolarHBondContact O-N 3.38Å; T138-L388 HydrophobicContact CG2-CD2 4.28Å
139	N	48.2	Very low	53.7	Low	101 Å²	101	92.7 Å²	92.7	54%	0.54	55%	0.548	S	S	.	.	H	α-helix	trans	-77.4	-29.8	-179.7	-70.4	-9.8	0	0	0	112.5	K135 V136 T137	K135-N139 VanDerWaalsContact O-CG 3.27Å; K135-N139 PolarHBondContact O-N 2.86Å; K135-N139 PolarHBondContact O-ND2 2.7Å; V136-N139 PolarHBondContact O-N 3.42Å; T137-N139 VanDerWaalsContact C-N 3.31Å; T137-N139 PolarHBondContact O-N 3.01Å
140	V	45.8	Very low	50.8	Low	102 Å²	102	100 Å²	100	62%	0.618	57%	0.573	S	S	*	*	H	α-helix	trans	-67.2	-42.1	172.1	172.3	0	0	0	0	110.7	V136 T137 K142 N143	V136-V140 WeakPolarHBondContact O-CG2 3.2Å; V136-V140 PolarHBondContact O-N 3.04Å; V136-V140 VanDerWaalsContact O-N 3.07Å; T137-V140 PolarHBondContact O-N 3.19Å; V140-K142 PolarHBondContact O-N 2.8Å; V140-N143 PolarHBondContact O-N 2.95Å
141	S	42.2	Very low	48	Very low	78 Å²	78	102.6 Å²	102.6	55%	0.545	60%	0.604	S	S	.	*	H	α-helix	trans	-60.7	-45	180	-163	0	0	0	0	112.7	T137 N143 G144	T137-S141 PolarHBondContact O-N 3.34Å; S141-N143 PolarHBondContact O-N 3.26Å; S141-N143 VanDerWaalsContact O-N 3.08Å; S141-G144 PolarHBondContact O-N 2.91Å
142	K	41.9	Very low	45.3	Very low	165 Å²	165	109 Å²	109	72%	0.717	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-19.2	-179.5	-72.6	-176.6	177.2	-175.5	0	115.1	T138 V140	T138-K142 PolarHBondContact O-N 3.38Å; V140-K142 PolarHBondContact O-N 2.8Å
143	N	39	Very low	42.6	Very low	147 Å²	147	114 Å²	114	79%	0.786	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-0.2	177.9	-72	-13.3	0	0	0	113.3	V140 S141	V140-N143 PolarHBondContact O-N 2.95Å; S141-N143 PolarHBondContact O-N 3.26Å; S141-N143 VanDerWaalsContact O-N 3.08Å
144	G	34.8	Very low	40.2	Very low	59 Å²	59	119.5 Å²	119.5	61%	0.608	68%	0.683	S	S	*	*	S	Bend	trans	-84.4	-23.2	-176.4	0	0	0	0	0	115.5	S141 K146	S141-G144 PolarHBondContact O-N 2.91Å; G144-K146 PolarHBondContact O-N 3.12Å
145	E	34.5	Very low	37.9	Very low	181 Å²	181	120.7 Å²	120.7	85%	0.846	70%	0.7	S	S	*	*			trans	-94.8	39.7	-167.2	-62.6	-172.3	149	0	0	114.7
146	K	38.5	Very low	35.6	Very low	208 Å²	208	120.8 Å²	120.8	90%	0.904	71%	0.714	S	S	*	*			trans	-131.3	86.6	168.9	-76.9	-168.9	175.8	-177.9	0	112.5	G144	G144-K146 PolarHBondContact O-N 3.12Å
147	G	27.9	Very low	33.9	Very low	79 Å²	79	122 Å²	122	81%	0.814	72%	0.722	S	S	*	*			trans	148.5	98.4	154.1	0	0	0	0	0	116.8
148	A	26.7	Very low	32.3	Very low	84 Å²	84	125.8 Å²	125.8	69%	0.694	74%	0.738	S	S	*	*			trans	-165	65.1	148.6	0	0	0	0	0	112.2	Y150	A148-Y150 HydrophobicContact CB-CE2 4.48Å
149	G	26.2	Very low	31	Very low	83 Å²	83	127.4 Å²	127.4	86%	0.856	76%	0.762	S	S	*	*			trans	-100.7	126	170.1	0	0	0	0	0	111
150	Y	26.6	Very low	29.7	Very low	224 Å²	224	128.4 Å²	128.4	88%	0.878	78%	0.777	S	S	*	*			trans	-102.6	128.9	-174.2	-66.4	-102.2	0	0	0	112.7	A148	A148-Y150 HydrophobicContact CB-CE2 4.48Å
151	G	25.2	Very low	28.5	Very low	69 Å²	69	131.8 Å²	131.8	71%	0.711	79%	0.787	S	S	*	*			trans	90.6	116.2	139.4	0	0	0	0	0	120.5
152	N	24.6	Very low	27.6	Very low	166 Å²	166	133.9 Å²	133.9	89%	0.888	80%	0.796	S	S	*	*			trans	54.1	129.6	149.8	-61.7	-1.6	0	0	0	119.1
153	E	24.7	Very low	26.7	Very low	199 Å²	199	132.9 Å²	132.9	93%	0.93	80%	0.804	S	S	*	*				-155.1	-161.7	62	-139.4	174	-161.9	0	0	114.2
154	M	24	Very low	25.9	Very low	176 Å²	176	135 Å²	135	87%	0.867	81%	0.808	S	S	*	*			trans	-130.4	141.4	-147.6	170	171.8	170.6	0	0	116.1
155	A	23.7	Very low	25.5	Very low	77 Å²	77	140.9 Å²	140.9	64%	0.636	82%	0.822	S	S	*	*			trans	75.8	118.8	151.6	0	0	0	0	0	123.3
156	S	23	Very low	25.2	Very low	109 Å²	109	141.1 Å²	141.1	76%	0.762	82%	0.824	S	S	*	*				83.8	115.5	122	-74.3	0	0	0	0	124.4
157	V	25	Very low	24.6	Very low	121 Å²	121	140.3 Å²	140.3	73%	0.733	82%	0.823	S	S	*	*				101.2	100.9	119.8	170.7	0	0	0	0	120.4
158	L	23.2	Very low	24.8	Very low	172 Å²	172	144.5 Å²	144.5	90%	0.901	82%	0.822	S	S	*	*			trans	68.4	120.1	137.7	-65.3	176	0	0	0	122.9
159	G	24.6	Very low	25.6	Very low	75 Å²	75	144.3 Å²	144.3	77%	0.773	81%	0.813	S	S	*	*			trans	-179.2	108.1	151.7	0	0	0	0	0	111.3
160	S	22.2	Very low	26	Very low	122 Å²	122	151 Å²	151	85%	0.853	81%	0.814	S	S	*	*			trans	-64.6	156.8	165.3	-58.1	0	0	0	0	109.5
161	E	20.7	Very low	26.4	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	80%	0.798	S	S	*	*			cis	-164.4	145.9	48.1	-159.1	168.3	-164.7	0	0	112
162	T	22.8	Very low	27	Very low	122 Å²	122	146.8 Å²	146.8	75%	0.748	79%	0.79	S	S	*	*			trans	27.8	126.6	160.9	56.3	0	0	0	0	122.5
163	V	22.4	Very low	27.6	Very low	144 Å²	144	145.8 Å²	145.8	87%	0.873	78%	0.784	S	S	*	*				-160.1	156.1	114.3	160.6	0	0	0	0	108.1
164	E	23.5	Very low	28.2	Very low	190 Å²	190	145.6 Å²	145.6	89%	0.888	78%	0.777	S	S	*	*			trans	-65.7	151.5	-169.7	-60.7	164.3	143.7	0	0	115.4
165	M	24.6	Very low	28.8	Very low	183 Å²	183	144.1 Å²	144.1	90%	0.901	76%	0.761	S	S	*	*			trans	-141.3	130.6	160.4	-171.9	169.7	70.6	0	0	109
166	E	28.6	Very low	29.6	Very low	186 Å²	186	143 Å²	143	87%	0.869	75%	0.752	S	S	*	*			trans	-77.4	137.6	-173.1	-59.2	-176.7	133	0	0	112.5
167	E	26.3	Very low	30.5	Very low	192 Å²	192	141.2 Å²	141.2	90%	0.897	74%	0.74	S	S	*	*			trans	-91.3	100.2	169.3	-75.2	-165.9	155.1	0	0	111.6
168	E	31.8	Very low	31.6	Very low	167 Å²	167	136.9 Å²	136.9	78%	0.78	72%	0.719	S	S	*	*			trans	-92.3	162.5	158.2	-88.6	-134.6	146.2	0	0	111.4
169	P	43.7	Very low	32.5	Very low	79 Å²	79	133 Å²	133	51%	0.513	70%	0.697	S	S	.	*	S	Bend	cis	-134.2	40.5	-33.1	36.1	-18.4	0	0	0	111.5
170	Y	34.1	Very low	33.6	Very low	223 Å²	223	132.1 Å²	132.1	88%	0.875	68%	0.682	S	S	*	*	S	Bend	trans	-86	-15.5	-176.4	-133.6	-96.7	0	0	0	114.7
171	N	36.7	Very low	34.9	Very low	102 Å²	102	130.6 Å²	130.6	55%	0.545	67%	0.668	S	S	.	*	H	α-helix	trans	-85.1	-20.4	-173	-123.2	-30.1	0	0	0	113.9	R175	N171-R175 WeakPolarHBondContact O-CB 3.46Å; N171-R175 PolarHBondContact O-N 2.88Å; N171-R175 VanDerWaalsContact O-N 3.14Å
172	N	35.9	Very low	36.1	Very low	103 Å²	103	129.8 Å²	129.8	55%	0.551	66%	0.657	S	S	*	*	H	α-helix	trans	-76.4	-36.1	-173	-69.7	-20.7	0	0	0	113.1	R175 A176	N172-R175 PolarHBondContact O-N 3.4Å; N172-A176 VanDerWaalsContact O-CB 3.31Å; N172-A176 WeakPolarHBondContact O-CB 3.18Å; N172-A176 PolarHBondContact O-N 2.88Å
173	L	37.1	Very low	37.5	Very low	146 Å²	146	127.9 Å²	127.9	76%	0.764	65%	0.649	S	S	*	*	H	α-helix	trans	-67.6	-38	176.2	-71.3	170.9	0	0	0	112.4	S177	L173-S177 WeakPolarHBondContact O-CB 3.34Å; L173-S177 PolarHBondContact O-N 2.65Å
174	Y	37.4	Very low	38.6	Very low	195 Å²	195	126.7 Å²	126.7	77%	0.765	64%	0.637	S	S	*	*	H	α-helix	trans	-72.2	-36.7	177.6	-152.3	-95.1	0	0	0	111.7	G178	Y174-G178 PolarHBondContact O-N 3.27Å
175	R	36.8	Very low	40	Very low	144 Å²	144	120.3 Å²	120.3	54%	0.543	62%	0.617	S	S	.	*	H	α-helix	trans	-66.4	-45.9	174.1	-164.4	179.2	-57.6	-164.1	4.5	112	N171 N172 S177 G178 E179	N171-R175 WeakPolarHBondContact O-CB 3.46Å; N171-R175 PolarHBondContact O-N 2.88Å; N171-R175 VanDerWaalsContact O-N 3.14Å; N172-R175 PolarHBondContact O-N 3.4Å; R175-S177 PolarHBondContact O-N 3.12Å; R175-G178 CarbonylContact O-C 3.56Å; R175-G178 PolarHBondContact O-N 3.36Å; R175-G178 VanDerWaalsContact O-N 3.17Å; R175-E179 WeakPolarHBondContact O-CB 3.38Å; R175-E179 WeakPolarHBondContact O-CG 3.32Å; R175-E179 PolarHBondContact O-N 2.85Å
176	A	40.1	Very low	41	Very low	54 Å²	54	114 Å²	114	45%	0.446	59%	0.594	S	S	.	*	H	α-helix	trans	-60.3	-42.5	175.9	0	0	0	0	0	112.2	N172 E179 A180	N172-A176 VanDerWaalsContact O-CB 3.31Å; N172-A176 WeakPolarHBondContact O-CB 3.18Å; N172-A176 PolarHBondContact O-N 2.88Å; A176-E179 PolarHBondContact O-N 3.43Å; A176-A180 WeakPolarHBondContact O-CB 3.48Å; A176-A180 PolarHBondContact O-N 2.79Å
177	S	43.7	Very low	41.9	Very low	71 Å²	71	107.5 Å²	107.5	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-62.4	-42.5	173.6	-173.6	0	0	0	0	112.4	L173 R175 E179 T181	L173-S177 WeakPolarHBondContact O-CB 3.34Å; L173-S177 PolarHBondContact O-N 2.65Å; R175-S177 PolarHBondContact O-N 3.12Å; S177-E179 VanDerWaalsContact C-N 3.32Å; S177-E179 PolarHBondContact O-N 2.87Å; S177-T181 WeakPolarHBondContact O-CB 3.19Å; S177-T181 PolarHBondContact O-N 2.9Å; S177-T181 PolarHBondContact O-OG1 3.03Å
178	G	48.1	Very low	42.9	Very low	30 Å²	30	103.2 Å²	103.2	31%	0.309	56%	0.555	S	S	.	*	H	α-helix	trans	-70.5	-22.2	176.6	0	0	0	0	0	114.6	Y174 R175 R182	Y174-G178 PolarHBondContact O-N 3.27Å; R175-G178 CarbonylContact O-C 3.56Å; R175-G178 PolarHBondContact O-N 3.36Å; R175-G178 VanDerWaalsContact O-N 3.17Å; G178-R182 WeakPolarHBondContact O-CG 3.28Å; G178-R182 PolarHBondContact O-N 3.3Å; G178-R182 PolarHBondContact O-NE 2.96Å
179	E	42.1	Very low	43.4	Very low	91 Å²	91	99.6 Å²	99.6	43%	0.425	54%	0.541	S	S	.	.	H	α-helix	trans	-85.8	-43	174.8	-76.5	171.2	-177.4	0	0	111.5	R175 A176 S177 T181 R182 S183	R175-E179 WeakPolarHBondContact O-CB 3.38Å; R175-E179 WeakPolarHBondContact O-CG 3.32Å; R175-E179 PolarHBondContact O-N 2.85Å; A176-E179 PolarHBondContact O-N 3.43Å; S177-E179 VanDerWaalsContact C-N 3.32Å; S177-E179 PolarHBondContact O-N 2.87Å; E179-T181 VanDerWaalsContact C-N 3.32Å; E179-T181 PolarHBondContact O-N 3.35Å; E179-R182 PolarHBondContact O-N 2.96Å; E179-R182 IonicContact OE1-NH2 2.75Å; E179-R182 PolarHBondContact OE1-NH2 3.43Å; E179-S183 PolarHBondContact O-N 3.37Å
180	A	46	Very low	43.5	Very low	56 Å²	56	101.6 Å²	101.6	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-57.1	-45.2	170.3	0	0	0	0	0	111.5	A176 R182 S183 L184	A176-A180 WeakPolarHBondContact O-CB 3.48Å; A176-A180 PolarHBondContact O-N 2.79Å; A180-R182 PolarHBondContact O-N 3.1Å; A180-S183 PolarHBondContact O-N 2.96Å; A180-L184 WeakPolarHBondContact O-CB 3.41Å; A180-L184 PolarHBondContact O-N 2.7Å
181	T	50.2	Low	44.1	Very low	91 Å²	91	97.3 Å²	97.3	56%	0.558	54%	0.537	S	S	*	.	H	α-helix	trans	-63.6	-38.2	177.4	-53.1	0	0	0	0	112.2	S177 E179 A185	S177-T181 WeakPolarHBondContact O-CB 3.19Å; S177-T181 PolarHBondContact O-N 2.9Å; S177-T181 PolarHBondContact O-OG1 3.03Å; E179-T181 VanDerWaalsContact C-N 3.32Å; E179-T181 PolarHBondContact O-N 3.35Å; T181-A185 WeakPolarHBondContact O-CB 3.39Å; T181-A185 PolarHBondContact O-N 2.98Å
182	R	46.5	Very low	44.6	Very low	157 Å²	157	97.5 Å²	97.5	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-70.9	-39.6	175.8	-80.5	-179.5	-72	145	-9.4	112.7	G178 E179 A180 A185 A186	G178-R182 WeakPolarHBondContact O-CG 3.28Å; G178-R182 PolarHBondContact O-N 3.3Å; G178-R182 PolarHBondContact O-NE 2.96Å; E179-R182 PolarHBondContact O-N 2.96Å; E179-R182 IonicContact OE1-NH2 2.75Å; E179-R182 PolarHBondContact OE1-NH2 3.43Å; A180-R182 PolarHBondContact O-N 3.1Å; R182-A185 PolarHBondContact O-N 3.17Å; R182-A186 WeakPolarHBondContact O-CB 3.4Å; R182-A186 PolarHBondContact O-N 2.74Å
183	S	51.6	Low	45.4	Very low	82 Å²	82	98.6 Å²	98.6	57%	0.573	55%	0.548	S	S	*	.	H	α-helix	trans	-66.3	-38.9	174	-75.1	0	0	0	0	112.3	E179 A180 A186 A187	E179-S183 PolarHBondContact O-N 3.37Å; A180-S183 PolarHBondContact O-N 2.96Å; S183-A186 PolarHBondContact O-N 3Å; S183-A187 VanDerWaalsContact O-CB 3.27Å; S183-A187 WeakPolarHBondContact O-CB 3.39Å; S183-A187 PolarHBondContact O-N 3.12Å
184	L	46.3	Very low	45.7	Very low	118 Å²	118	94.5 Å²	94.5	62%	0.618	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-43	174.3	-124.2	90.2	0	0	0	111.7	A180 A187 L188	A180-L184 WeakPolarHBondContact O-CB 3.41Å; A180-L184 PolarHBondContact O-N 2.7Å; L184-A187 PolarHBondContact O-N 2.78Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 WeakPolarHBondContact O-CG 3.31Å; L184-L188 PolarHBondContact O-N 2.75Å
185	A	51.9	Low	46.2	Very low	56 Å²	56	93 Å²	93	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-62.5	-44.2	176.2	0	0	0	0	0	111.7	T181 R182 L188 D189	T181-A185 WeakPolarHBondContact O-CB 3.39Å; T181-A185 PolarHBondContact O-N 2.98Å; R182-A185 PolarHBondContact O-N 3.17Å; A185-L188 PolarHBondContact O-N 2.87Å; A185-D189 WeakPolarHBondContact O-CB 3.39Å; A185-D189 PolarHBondContact O-N 2.98Å
186	A	46.5	Very low	46.8	Very low	52 Å²	52	92.1 Å²	92.1	43%	0.43	54%	0.543	S	S	.	.	H	α-helix	trans	-64.3	-41.4	175.6	0	0	0	0	0	112.4	R182 S183 D189 I190	R182-A186 WeakPolarHBondContact O-CB 3.4Å; R182-A186 PolarHBondContact O-N 2.74Å; S183-A186 PolarHBondContact O-N 3Å; A186-D189 PolarHBondContact O-N 3Å; A186-I190 WeakPolarHBondContact O-CB 3.25Å; A186-I190 WeakPolarHBondContact O-CD1 3.42Å; A186-I190 WeakPolarHBondContact O-CG1 3.15Å; A186-I190 PolarHBondContact O-N 3.27Å
187	A	48.1	Very low	47.2	Very low	49 Å²	49	96 Å²	96	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-65	-40.3	176.2	0	0	0	0	0	112.3	S183 L184 L191	S183-A187 VanDerWaalsContact O-CB 3.27Å; S183-A187 WeakPolarHBondContact O-CB 3.39Å; S183-A187 PolarHBondContact O-N 3.12Å; L184-A187 PolarHBondContact O-N 2.78Å; A187-L191 VanDerWaalsContact O-CG 3.29Å; A187-L191 WeakPolarHBondContact O-CG 3.4Å; A187-L191 PolarHBondContact O-N 3.24Å
188	L	45.7	Very low	47.2	Very low	102 Å²	102	95.4 Å²	95.4	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-42.1	174.8	-76.5	166.3	0	0	0	111.9	L184 A185 I190 L191 T192	L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 WeakPolarHBondContact O-CG 3.31Å; L184-L188 PolarHBondContact O-N 2.75Å; A185-L188 PolarHBondContact O-N 2.87Å; L188-I190 PolarHBondContact O-N 3.27Å; L188-L191 CarbonylContact O-C 3.5Å; L188-L191 WeakPolarHBondContact O-CB 3.17Å; L188-L191 PolarHBondContact O-N 3.32Å; L188-L191 VanDerWaalsContact O-N 3.09Å; L188-T192 PolarHBondContact O-N 2.82Å; L188-T192 PolarHBondContact O-OG1 2.74Å; L188-T192 VanDerWaalsContact O-OG1 3.04Å
189	D	42.2	Very low	46.8	Very low	91 Å²	91	101.2 Å²	101.2	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-66	-38.9	-179.8	-159.9	9.4	0	0	0	111.9	A185 A186 L191 T192 N193	A185-D189 WeakPolarHBondContact O-CB 3.39Å; A185-D189 PolarHBondContact O-N 2.98Å; A186-D189 PolarHBondContact O-N 3Å; D189-L191 VanDerWaalsContact C-N 3.3Å; D189-L191 PolarHBondContact O-N 2.83Å; D189-T192 WeakPolarHBondContact CA-OG1 3.5Å; D189-T192 PolarHBondContact O-N 3.16Å; D189-T192 PolarHBondContact O-OG1 3.31Å; D189-N193 PolarHBondContact O-N 3.04Å; D189-N193 VanDerWaalsContact O-N 3.09Å; D189-N193 PolarHBondContact OD1-ND2 2.96Å
190	I	47.7	Very low	46.8	Very low	120 Å²	120	103 Å²	103	62%	0.615	59%	0.588	S	S	*	*	H	α-helix	trans	-59.2	-39.3	170.3	-70.3	164.6	0	0	0	111.6	A186 L188 S194	A186-I190 WeakPolarHBondContact O-CB 3.25Å; A186-I190 WeakPolarHBondContact O-CD1 3.42Å; A186-I190 WeakPolarHBondContact O-CG1 3.15Å; A186-I190 PolarHBondContact O-N 3.27Å; L188-I190 PolarHBondContact O-N 3.27Å; I190-S194 WeakPolarHBondContact O-CB 3.36Å; I190-S194 PolarHBondContact O-OG 3.22Å
191	L	44.8	Very low	46.7	Very low	133 Å²	133	107 Å²	107	70%	0.696	60%	0.6	S	S	*	*	H	α-helix	trans	-75.8	-26.8	178.8	-72.1	168.3	0	0	0	113.4	A187 L188 D189	A187-L191 VanDerWaalsContact O-CG 3.29Å; A187-L191 WeakPolarHBondContact O-CG 3.4Å; A187-L191 PolarHBondContact O-N 3.24Å; L188-L191 CarbonylContact O-C 3.5Å; L188-L191 WeakPolarHBondContact O-CB 3.17Å; L188-L191 PolarHBondContact O-N 3.32Å; L188-L191 VanDerWaalsContact O-N 3.09Å; D189-L191 VanDerWaalsContact C-N 3.3Å; D189-L191 PolarHBondContact O-N 2.83Å
192	T	48.8	Very low	46	Very low	106 Å²	106	109.9 Å²	109.9	65%	0.65	61%	0.607	S	S	*	*	H	α-helix	trans	-89.7	-21.3	-179.8	46.3	0	0	0	0	115.1	L188 D189	L188-T192 PolarHBondContact O-N 2.82Å; L188-T192 PolarHBondContact O-OG1 2.74Å; L188-T192 VanDerWaalsContact O-OG1 3.04Å; D189-T192 WeakPolarHBondContact CA-OG1 3.5Å; D189-T192 PolarHBondContact O-N 3.16Å; D189-T192 PolarHBondContact O-OG1 3.31Å
193	N	52.6	Low	45.5	Very low	127 Å²	127	109.3 Å²	109.3	68%	0.679	62%	0.616	S	S	*	*	H	α-helix	trans	-110.4	2.6	-174.2	-83.8	-53.4	0	0	0	115.7	D189 N195	D189-N193 PolarHBondContact O-N 3.04Å; D189-N193 VanDerWaalsContact O-N 3.09Å; D189-N193 PolarHBondContact OD1-ND2 2.96Å; N193-N195 PolarHBondContact O-N 3.01Å
194	S	42.1	Very low	44.9	Very low	60 Å²	60	112.3 Å²	112.3	42%	0.42	62%	0.624	S	S	.	*			trans	-93.8	75.8	-173.4	47.8	0	0	0	0	114.9	I190 N196	I190-S194 WeakPolarHBondContact O-CB 3.36Å; I190-S194 PolarHBondContact O-OG 3.22Å; S194-N196 PolarHBondContact O-N 2.88Å
195	N	48.6	Very low	44.5	Very low	163 Å²	163	114.4 Å²	114.4	87%	0.872	64%	0.636	S	S	*	*			trans	-67.7	58.3	163.5	-91	-21.5	0	0	0	112.4	N193	N193-N195 PolarHBondContact O-N 3.01Å
196	N	49.5	Very low	43.5	Very low	126 Å²	126	114.7 Å²	114.7	67%	0.674	64%	0.644	S	S	*	*			trans	-168.2	53.3	170.5	-108.3	-52.2	0	0	0	114.4	S194 G198	S194-N196 PolarHBondContact O-N 2.88Å; N196-G198 PolarHBondContact O-N 3.29Å; N196-G198 VanDerWaalsContact O-N 3.14Å
197	I	47.6	Very low	42.6	Very low	136 Å²	136	119.9 Å²	119.9	70%	0.697	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-62.3	-19	176.9	-73.4	172.3	0	0	0	113.2	K199	I197-K199 VanDerWaalsContact C-N 3.28Å; I197-K199 PolarHBondContact O-N 2.94Å
198	G	43.5	Very low	41.9	Very low	58 Å²	58	127.1 Å²	127.1	60%	0.598	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-69.5	-9.2	-178.4	0	0	0	0	0	116.9	N196	N196-G198 PolarHBondContact O-N 3.29Å; N196-G198 VanDerWaalsContact O-N 3.14Å
199	K	41.4	Very low	40.9	Very low	152 Å²	152	128.3 Å²	128.3	66%	0.661	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-104.7	0.2	-171.6	-110.3	-176.3	179.4	-176.4	0	116.7	I197	I197-K199 VanDerWaalsContact C-N 3.28Å; I197-K199 PolarHBondContact O-N 2.94Å
200	I	42.2	Very low	40.1	Very low	128 Å²	128	127.3 Å²	127.3	66%	0.656	71%	0.714	S	S	*	*	S	Bend	trans	-96.2	-24.6	-180	-63.2	176.7	0	0	0	111.5	E202 N203	I200-E202 PolarHBondContact O-N 3.42Å; I200-N203 PolarHBondContact O-N 3.01Å
201	I	43.6	Very low	39	Very low	141 Å²	141	128.1 Å²	128.1	72%	0.723	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-74.5	-22.2	-176.5	-62.8	175.4	0	0	0	112.6
202	E	34.9	Very low	38	Very low	151 Å²	151	127.7 Å²	127.7	71%	0.706	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-77.4	-19.5	176.9	-76.8	-175.8	134.5	0	0	114.4	I200 I204	I200-E202 PolarHBondContact O-N 3.42Å; E202-I204 PolarHBondContact O-N 3.37Å
203	N	36.9	Very low	36.9	Very low	145 Å²	145	130 Å²	130	78%	0.775	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-92.6	10.8	-167.8	-85.4	1.8	0	0	0	116	I200	I200-N203 PolarHBondContact O-N 3.01Å
204	I	38.3	Very low	35.5	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	74%	0.739	S	S	*	*	S	Bend	trans	-109.1	-18.9	177.6	-62.3	-179	0	0	0	112.7	E202	E202-I204 PolarHBondContact O-N 3.37Å
205	N	37.2	Very low	34.6	Very low	162 Å²	162	132.4 Å²	132.4	87%	0.866	76%	0.757	S	S	*	*	S	Bend	trans	-109.5	42.7	-175.6	-84.5	-13.2	0	0	0	113.9
206	G	30.8	Very low	33.5	Very low	61 Å²	61	132.9 Å²	132.9	63%	0.629	75%	0.754	S	S	*	*			trans	-154.4	72.3	-177.2	0	0	0	0	0	115.5
207	D	28.3	Very low	32.3	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	76%	0.763	S	S	*	*				-166	127.1	128.2	-114.6	-24	0	0	0	114.4
208	K	33.6	Very low	31.2	Very low	201 Å²	201	131.8 Å²	131.8	87%	0.874	77%	0.769	S	S	*	*			trans	-148.6	97.5	162.5	-92.6	-167.8	179.6	177.9	0	109.4
209	S	24.7	Very low	30.2	Very low	127 Å²	127	137.6 Å²	137.6	89%	0.888	78%	0.781	S	S	*	*			trans	166	138.1	140.1	-78.2	0	0	0	0	110.7
210	G	25	Very low	29.4	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	79%	0.785	S	S	*	*			cis	164.6	-160	-3.5	0	0	0	0	0	112.7
211	V	24.1	Very low	28.5	Very low	137 Å²	137	138.9 Å²	138.9	83%	0.83	79%	0.79	S	S	*	*			trans	69.9	115.2	164	-170.1	0	0	0	0	117.6
212	V	24.4	Very low	27.5	Very low	125 Å²	125	139.1 Å²	139.1	76%	0.758	79%	0.787	S	S	*	*				-166.9	125.1	116	142.8	0	0	0	0	111.8
213	H	25.5	Very low	27	Very low	153 Å²	153	137.4 Å²	137.4	71%	0.708	79%	0.787	S	S	*	*			trans	33.9	121.8	158	-60.4	-56.3	0	0	0	125.7
214	N	23.4	Very low	26.5	Very low	160 Å²	160	134.6 Å²	134.6	86%	0.856	78%	0.784	S	S	*	*				24.8	129.4	126.4	-60.4	1.7	0	0	0	121.1
215	G	23.8	Very low	25.8	Very low	79 Å²	79	137.1 Å²	137.1	81%	0.814	79%	0.792	S	S	*	*			trans	-170.9	82.1	165.6	0	0	0	0	0	114.3
216	E	25.1	Very low	25.2	Very low	173 Å²	173	133.2 Å²	133.2	81%	0.808	79%	0.79	S	S	*	*			trans	15.6	137.6	154.9	-58.9	-175.4	149	0	0	123.9
217	N	24	Very low	25	Very low	159 Å²	159	134 Å²	134	85%	0.85	80%	0.799	S	S	*	*			trans	57.3	126.5	138.6	-61.5	-25.9	0	0	0	122
218	G	25.6	Very low	24.9	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	80%	0.799	S	S	*	*			trans	-176	97.1	166.5	0	0	0	0	0	113.8
219	E	22.2	Very low	24.5	Very low	180 Å²	180	134.5 Å²	134.5	84%	0.841	79%	0.794	S	S	*	*			trans	-64.4	164.6	-178.4	-101.1	-176.2	119.6	0	0	116.8
220	S	23.2	Very low	24.5	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	79%	0.789	S	S	*	*			trans	107.8	115.5	148.3	72.6	0	0	0	0	117.4
221	R	23.4	Very low	24.4	Very low	198 Å²	198	140.1 Å²	140.1	75%	0.747	80%	0.796	S	S	*	*				63.1	124.9	69.4	-91.8	174.5	160.7	173.5	-5.4	111.3
222	H	24	Very low	24.5	Very low	145 Å²	145	141.5 Å²	141.5	67%	0.671	80%	0.795	S	S	*	*			cis	-165.1	150.5	39.7	-101	-65.3	0	0	0	113
223	V	23.3	Very low	24.6	Very low	116 Å²	116	143 Å²	143	70%	0.703	80%	0.798	S	S	*	*				60.9	113	128.1	175.2	0	0	0	0	118.2
224	A	25.7	Very low	24.6	Very low	85 Å²	85	143.1 Å²	143.1	70%	0.702	80%	0.799	S	S	*	*				63.1	116.3	65.1	0	0	0	0	0	112.9
225	E	25.5	Very low	24.9	Very low	199 Å²	199	141.5 Å²	141.5	93%	0.93	80%	0.8	S	S	*	*				178.4	166.5	85	-80.6	-176.4	131.9	0	0	105.3
226	G	24.5	Very low	25	Very low	79 Å²	79	144.5 Å²	144.5	81%	0.814	80%	0.798	S	S	*	*			cis	152.2	159.6	7.6	0	0	0	0	0	108.5
227	G	25.4	Very low	25.1	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	80%	0.8	S	S	*	*			trans	144.4	136.2	176.3	0	0	0	0	0	113.8
228	R	27.5	Very low	25.1	Very low	230 Å²	230	142.1 Å²	142.1	87%	0.868	80%	0.8	S	S	*	*			trans	-136.9	177.7	-170.3	-68.5	-179.9	171.1	172.3	-3.3	112.5
229	N	25	Very low	25.2	Very low	143 Å²	143	144 Å²	144	77%	0.765	80%	0.801	S	S	*	*			trans	97.6	124.6	157.9	-47.2	-28.9	0	0	0	113.6
230	V	24.6	Very low	25.3	Very low	129 Å²	129	144.4 Å²	144.4	78%	0.782	80%	0.803	S	S	*	*			cis	105.5	133.4	23	173.7	0	0	0	0	113.2
231	E	23.2	Very low	25.4	Very low	184 Å²	184	145.4 Å²	145.4	86%	0.86	81%	0.808	S	S	*	*			trans	126.5	123.2	168.1	-74.2	176.5	-170.9	0	0	111
232	M	24.3	Very low	25.5	Very low	167 Å²	167	144.1 Å²	144.1	82%	0.823	81%	0.811	S	S	*	*			cis	96.7	120.6	29.2	-85.5	-111.3	-132.5	0	0	116.2
233	L	27.9	Very low	25.5	Very low	155 Å²	155	145.1 Å²	145.1	81%	0.812	82%	0.82	S	S	*	*			trans	157.2	115.8	145.5	-104.2	96.3	0	0	0	107.5
234	E	25.5	Very low	25.5	Very low	157 Å²	157	143.2 Å²	143.2	73%	0.734	82%	0.824	S	S	*	*				80	122.8	67.3	-77.5	-171	178.1	0	0	116
235	S	29	Very low	25.4	Very low	125 Å²	125	143.7 Å²	143.7	87%	0.874	83%	0.828	S	S	*	*			trans	-171.7	128	144.4	9.5	0	0	0	0	111.2
236	D	25.1	Very low	25.3	Very low	143 Å²	143	141.4 Å²	141.4	77%	0.765	83%	0.827	S	S	*	*			trans	-93.4	164	-176.4	-55.7	-60.4	0	0	0	114.1
237	S	27.5	Very low	25.2	Very low	124 Å²	124	141.8 Å²	141.8	87%	0.867	83%	0.831	S	S	*	*			trans	-161.3	124.4	147.9	-81	0	0	0	0	111.8
238	D	24	Very low	25.1	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	83%	0.827	S	S	*	*			trans	-79.8	151.4	-177.5	-56.6	-65	0	0	0	114.2
239	S	28.4	Very low	25	Very low	121 Å²	121	137.5 Å²	137.5	85%	0.846	83%	0.828	S	S	*	*			trans	-157	120.2	141	71	0	0	0	0	111.5
240	E	23.9	Very low	24.9	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	83%	0.83	S	S	*	*			trans	-78.7	151	-178.9	-54.9	174.3	122.7	0	0	113.5
241	C	26.4	Very low	24.9	Very low	129 Å²	129	137.7 Å²	137.7	87%	0.872	83%	0.834	S	S	*	*			trans	176.6	76.5	157.1	-92.3	0	0	0	0	108.2
242	E	23.8	Very low	24.9	Very low	172 Å²	172	133 Å²	133	80%	0.804	83%	0.827	S	S	*	*				78.2	94	92.7	-158.2	176	-158.2	0	0	116.2
243	L	24.7	Very low	24.8	Very low	165 Å²	165	131.3 Å²	131.3	86%	0.864	83%	0.826	S	S	*	*			trans	59.8	124.4	142.8	-56.1	174.2	0	0	0	122.3
244	G	23.6	Very low	24.6	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	82%	0.824	S	S	*	*			trans	-175.4	42.2	175.2	0	0	0	0	0	121.4
245	A	23.8	Very low	24.5	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	82%	0.82	S	S	*	*			trans	59.7	102.1	151.9	0	0	0	0	0	123.7
246	V	22.8	Very low	24.3	Very low	152 Å²	152	131.3 Å²	131.3	92%	0.921	82%	0.82	S	S	*	*			trans	42.2	127.7	132.6	-74.5	0	0	0	0	125.4
247	G	23.5	Very low	24.3	Very low	86 Å²	86	127.5 Å²	127.5	89%	0.887	82%	0.815	S	S	*	*			trans	108.3	125.6	142.9	0	0	0	0	0	115.7
248	G	23.1	Very low	24.3	Very low	72 Å²	72	129.8 Å²	129.8	74%	0.742	82%	0.817	S	S	*	*			cis	149.4	157.3	0.3	0	0	0	0	0	111.1
249	V	25.3	Very low	24.6	Very low	147 Å²	147	131.4 Å²	131.4	89%	0.891	82%	0.82	S	S	*	*			trans	97.2	128	176.6	-174.6	0	0	0	0	116.6
250	D	21.5	Very low	24.4	Very low	148 Å²	148	133.8 Å²	133.8	79%	0.791	82%	0.823	S	S	*	*			trans	-90.4	164.8	-169.5	-46.6	-87.2	0	0	0	115.1
251	C	25.7	Very low	24.6	Very low	128 Å²	128	129.6 Å²	129.6	87%	0.865	82%	0.821	S	S	*	*				-179.2	136.6	115	-97.3	0	0	0	0	114.1
252	A	23.3	Very low	24.6	Very low	87 Å²	87	127.3 Å²	127.3	72%	0.719	81%	0.811	S	S	*	*			trans	9.1	126.2	157.9	0	0	0	0	0	119.4
253	V	22.7	Very low	24.5	Very low	131 Å²	131	126.7 Å²	126.7	79%	0.794	81%	0.813	S	S	*	*				55.6	116.4	57.1	-155.8	0	0	0	0	110.4
254	E	22.6	Very low	24.5	Very low	167 Å²	167	129.8 Å²	129.8	78%	0.78	81%	0.814	S	S	*	*				-166.1	127.9	71.7	-83.6	-178.6	163.6	0	0	109.1
255	T	24.2	Very low	24.5	Very low	107 Å²	107	131.3 Å²	131.3	66%	0.656	81%	0.812	S	S	*	*				95.7	135.1	93	59.6	0	0	0	0	115.4
256	D	24.7	Very low	24.6	Very low	162 Å²	162	134.1 Å²	134.1	87%	0.866	81%	0.809	S	S	*	*			trans	60.3	150.8	155	-49.4	-16.6	0	0	0	118.6
257	G	24.8	Very low	24.7	Very low	64 Å²	64	134.3 Å²	134.3	66%	0.66	80%	0.8	S	S	*	*			cis	172.2	162	-2.4	0	0	0	0	0	111.1
258	D	27.2	Very low	24.9	Very low	172 Å²	172	139.9 Å²	139.9	92%	0.92	79%	0.794	S	S	*	*			trans	70.7	139.9	164.7	-58.6	-23	0	0	0	121.6
259	E	29.7	Very low	24.9	Very low	190 Å²	190	142 Å²	142	89%	0.888	79%	0.789	S	S	*	*			trans	-95.7	151.7	-178.1	-51.8	174.7	143.2	0	0	109.7
260	D	25.7	Very low	25.1	Very low	171 Å²	171	142.9 Å²	142.9	91%	0.914	78%	0.781	S	S	*	*			trans	-148.3	136.2	159.1	-122.5	-28.7	0	0	0	112.5
261	A	28.1	Very low	25.5	Very low	100 Å²	100	140.1 Å²	140.1	83%	0.826	77%	0.769	S	S	*	*			trans	-90.8	123.4	-168.3	0	0	0	0	0	112.4
262	A	25.2	Very low	25.7	Very low	81 Å²	81	137.5 Å²	137.5	67%	0.669	74%	0.744	S	S	*	*			trans	-100.8	112	178.7	0	0	0	0	0	112.7
263	N	23.3	Very low	26	Very low	160 Å²	160	136.4 Å²	136.4	86%	0.856	73%	0.726	S	S	*	*			trans	-64.4	127.5	175.9	-174.5	8.1	0	0	0	112.1
264	W	24.1	Very low	26.1	Very low	229 Å²	229	134.8 Å²	134.8	87%	0.867	71%	0.71	S	S	*	*			trans	-107.4	110.1	178	-75.3	93.2	0	0	0	111.9
265	S	24.2	Very low	26.4	Very low	109 Å²	109	134.3 Å²	134.3	76%	0.762	71%	0.705	S	S	*	*			trans	-77.5	126.9	173.7	31.6	0	0	0	0	112.3	E267	S265-E267 PolarHBondContact O-N 3.04Å
266	E	25.1	Very low	26.4	Very low	153 Å²	153	136.8 Å²	136.8	72%	0.715	71%	0.709	S	S	*	*			trans	-74	106.3	178.7	-64.3	-171.7	145.8	0	0	112.7
267	E	23.9	Very low	26.5	Very low	156 Å²	156	138.3 Å²	138.3	73%	0.729	71%	0.711	S	S	*	*			trans	-92.7	123.3	163.7	-74.2	-164.5	167.6	0	0	112.3	S265 N269	S265-E267 PolarHBondContact O-N 3.04Å; E267-N269 VanDerWaalsContact C-N 3.27Å; E267-N269 PolarHBondContact O-N 3.49Å; E267-N269 PolarHBondContact OE2-ND2 2.53Å
268	R	28.5	Very low	26.6	Very low	204 Å²	204	142.9 Å²	142.9	77%	0.77	71%	0.713	S	S	*	*			trans	-76.8	68.8	174	-66.2	-170.5	-172	-174.4	5	112.3	E132	E132-R268 IonicContact OE1-NH1 2.98Å
269	N	23.3	Very low	26.5	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	71%	0.71	S	S	*	*			trans	-94.7	99.4	174.1	-74	-39.9	0	0	0	111.9	E267 V271	E267-N269 VanDerWaalsContact C-N 3.27Å; E267-N269 PolarHBondContact O-N 3.49Å; E267-N269 PolarHBondContact OE2-ND2 2.53Å; N269-V271 PolarHBondContact O-N 3.1Å
270	F	29.8	Very low	26.3	Very low	164 Å²	164	138.4 Å²	138.4	72%	0.719	70%	0.699	S	S	*	*			trans	-74.7	108.8	168.1	-174.5	-96.1	0	0	0	108.8	E272	F270-E272 PolarHBondContact O-N 3.38Å
271	V	30	Very low	26.5	Very low	91 Å²	91	136.8 Å²	136.8	55%	0.552	69%	0.694	S	S	*	*			trans	-82.1	100.2	-175.8	-178.8	0	0	0	0	110.4	N269	N269-V271 PolarHBondContact O-N 3.1Å
272	E	30	Very low	26.4	Very low	73 Å²	73	138.8 Å²	138.8	34%	0.341	69%	0.69	S	S	.	*			trans	-81	119.3	176.2	-161.7	163	-111.3	0	0	110.6	F270 H274 L625 V644	F270-E272 PolarHBondContact O-N 3.38Å; E272-H274 PolarHBondContact O-N 3.39Å; E272-H274 IonicContact OE2-CD2 3.24Å; E272-H274 IonicContact OE2-CE1 2.76Å; E272-H274 PolarHBondContact OE2-CE1 2.96Å; E272-H274 IonicContact OE2-NE2 3.26Å; E272-H274 PolarHBondContact OE2-NE2 3.13Å; E272-L625 VanDerWaalsContact OE1-CD1 3.25Å; E272-L625 WeakPolarHBondContact OE1-CD1 3.39Å; E272-V644 HydrophobicContact CG-CG1 4.29Å; E272-V644 HydrophobicContact CG-CG2 4.27Å
273	L	28.3	Very low	26.4	Very low	64 Å²	64	141.9 Å²	141.9	34%	0.335	70%	0.695	S	S	.	*			trans	-85.9	89.8	178.6	-69	176.4	0	0	0	110.2	F275	L273-F275 HydrophobicContact CB-CE2 4.35Å
274	H	24.8	Very low	26.4	Very low	97 Å²	97	143 Å²	143	45%	0.449	70%	0.695	S	S	.	*			trans	-74.6	129.4	171.5	-75.2	-85	0	0	0	111.2	E272 H642	E272-H274 PolarHBondContact O-N 3.39Å; E272-H274 IonicContact OE2-CD2 3.24Å; E272-H274 IonicContact OE2-CE1 2.76Å; E272-H274 PolarHBondContact OE2-CE1 2.96Å; E272-H274 IonicContact OE2-NE2 3.26Å; E272-H274 PolarHBondContact OE2-NE2 3.13Å; H274-H642 AromaticContact CE1-CG 3.98Å; H274-H642 AromaticContact CE1-ND1 3.95Å; H274-H642 AromaticContact ND1-ND1 3.81Å
275	F	29.2	Very low	26.7	Very low	156 Å²	156	137.2 Å²	137.2	68%	0.684	69%	0.687	S	S	*	*			trans	-117.1	113.5	165.9	-71.8	-87.5	0	0	0	108	L273 E277	L273-F275 HydrophobicContact CB-CE2 4.35Å; F275-E277 PolarHBondContact O-N 3.43Å
276	E	25.4	Very low	26.9	Very low	160 Å²	160	139.6 Å²	139.6	75%	0.748	69%	0.69	S	S	*	*			trans	-78	113.8	168.6	-68.6	-172.5	159.8	0	0	109.4	K278	E276-K278 PolarHBondContact O-N 3.15Å; E276-K278 VanDerWaalsContact O-N 3.14Å; E276-K278 WeakPolarHBondContact OE2-CE 3.38Å; E276-K278 IonicContact OE2-NZ 3.58Å
277	E	26.7	Very low	27.2	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	70%	0.696	S	S	*	*			trans	-69.9	102.5	160.1	-77.2	-179.3	137.3	0	0	108.2	F275 D279	F275-E277 PolarHBondContact O-N 3.43Å; E277-D279 PolarHBondContact O-N 3.06Å
278	K	25.3	Very low	27.3	Very low	160 Å²	160	141.6 Å²	141.6	70%	0.696	71%	0.705	S	S	*	*			trans	-84.9	107.2	166.2	-80.1	-178.1	178.7	170.1	0	109.4	E276 V280	E276-K278 PolarHBondContact O-N 3.15Å; E276-K278 VanDerWaalsContact O-N 3.14Å; E276-K278 WeakPolarHBondContact OE2-CE 3.38Å; E276-K278 IonicContact OE2-NZ 3.58Å; K278-V280 HydrophobicContact CB-CG2 4.49Å; K278-V280 PolarHBondContact O-N 3.28Å
279	D	25.8	Very low	27.3	Very low	163 Å²	163	135.1 Å²	135.1	87%	0.872	70%	0.702	S	S	*	*			trans	-58.7	106.4	166	-78.6	-44.5	0	0	0	109.9	E277	E277-D279 PolarHBondContact O-N 3.06Å
280	V	24.7	Very low	27.6	Very low	105 Å²	105	136.6 Å²	136.6	64%	0.636	71%	0.71	S	S	*	*			trans	-111.6	99.1	174.3	174.2	0	0	0	0	108.6	K278 I282	K278-V280 HydrophobicContact CB-CG2 4.49Å; K278-V280 PolarHBondContact O-N 3.28Å; V280-I282 HydrophobicContact CG1-CD1 3.53Å; V280-I282 HydrophobicContact CG1-CG1 3.74Å; V280-I282 PolarHBondContact O-N 3Å
281	V	29.8	Very low	27.4	Very low	137 Å²	137	136.6 Å²	136.6	83%	0.83	72%	0.716	S	S	*	*			trans	-72.5	109.5	171.1	179	0	0	0	0	108.7
282	I	26.4	Very low	27.2	Very low	142 Å²	142	138.5 Å²	138.5	73%	0.728	73%	0.728	S	S	*	*			trans	-125.3	129.7	169.6	-71.9	169.2	0	0	0	109	V280	V280-I282 HydrophobicContact CG1-CD1 3.53Å; V280-I282 HydrophobicContact CG1-CG1 3.74Å; V280-I282 PolarHBondContact O-N 3Å
283	N	24.8	Very low	27.2	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	75%	0.751	S	S	*	*			trans	-69.4	146.9	175	-62.7	-61.8	0	0	0	111
284	E	23.8	Very low	27.3	Very low	183 Å²	183	147.8 Å²	147.8	86%	0.855	77%	0.77	S	S	*	*			trans	-49.6	148.2	158.5	-90.3	-165.9	-159.8	0	0	110.8
285	P	31.7	Very low	27.6	Very low	109 Å²	109	151.1 Å²	151.1	71%	0.708	79%	0.79	S	S	*	*				-156.4	-179	62.2	38.8	-15.4	0	0	0	119.7
286	I	26.6	Very low	27.7	Very low	159 Å²	159	151.1 Å²	151.1	82%	0.815	80%	0.796	S	S	*	*			trans	89.3	126.6	159.1	-46.3	-173.1	0	0	0	117.8
287	Q	33.3	Very low	28	Very low	179 Å²	179	149.1 Å²	149.1	84%	0.836	80%	0.796	S	S	*	*			trans	-68.9	137	176.3	-61.2	165.1	-27.3	0	0	112.7
288	N	26	Very low	28.4	Very low	171 Å²	171	148.8 Å²	148.8	91%	0.914	80%	0.795	S	S	*	*			trans	-159	153.4	133.5	-98.6	-33.5	0	0	0	109.6
289	G	27.3	Very low	28.5	Very low	69 Å²	69	148.2 Å²	148.2	71%	0.711	80%	0.799	S	S	*	*			trans	-95.2	-165.4	-158.7	0	0	0	0	0	117.6
290	D	29.7	Very low	28.7	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	80%	0.8	S	S	*	*			trans	74.2	72.6	164.6	-58.6	-16.2	0	0	0	119.5
291	L	26.1	Very low	29	Very low	164 Å²	164	153.8 Å²	153.8	86%	0.859	81%	0.809	S	S	*	*			trans	-135.3	86.8	140.4	-76.5	-179.1	0	0	0	110.4
292	V	26.1	Very low	29	Very low	130 Å²	130	152.9 Å²	152.9	79%	0.788	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.9	116.5	173.5	176.6	0	0	0	0	109.5
293	W	30.2	Very low	29.1	Very low	221 Å²	221	153 Å²	153	84%	0.837	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-78.4	134.9	167.4	-68	101	0	0	0	110.3
294	P	29.9	Very low	29.3	Very low	111 Å²	111	152.6 Å²	152.6	72%	0.721	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.9	144.8	-175	27.9	-34.3	0	0	0	112.6
295	L	30.6	Very low	29.5	Very low	167 Å²	167	148 Å²	148	87%	0.874	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-67.3	138.2	170.4	-83.1	85.4	0	0	0	110.9
296	I	32.3	Very low	29.5	Very low	157 Å²	157	148.9 Å²	148.9	81%	0.805	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74.9	130	171.8	-59.6	171.7	0	0	0	109.2
297	P	30.3	Very low	29.6	Very low	117 Å²	117	150.1 Å²	150.1	76%	0.76	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-63.5	131.9	171.5	-21.8	33.8	0	0	0	112.1
298	Q	34.8	Very low	29.6	Very low	186 Å²	186	146.8 Å²	146.8	87%	0.869	81%	0.81	S	S	*	*			trans	-87.7	108.7	165.5	-71.7	-178.7	-21	0	0	108.9
299	D	28.2	Very low	29.9	Very low	148 Å²	148	145 Å²	145	79%	0.791	81%	0.808	S	S	*	*			trans	-158	163.6	159.3	-95.5	-42.5	0	0	0	110.1
300	Y	29.4	Very low	29.9	Very low	225 Å²	225	146.1 Å²	146.1	88%	0.882	81%	0.811	S	S	*	*			trans	78.1	77.2	-172.1	-60	-81.7	0	0	0	117
301	I	31.3	Very low	29.8	Very low	161 Å²	161	145.3 Å²	145.3	83%	0.826	81%	0.813	S	S	*	*			trans	-112.5	137.9	147.9	-64.5	176.3	0	0	0	107.4
302	P	30.8	Very low	30.1	Very low	117 Å²	117	146.2 Å²	146.2	76%	0.76	81%	0.813	S	S	*	*			trans	-68.9	144.8	-179.2	-16.7	30.4	0	0	0	113.2
303	V	28.4	Very low	30.2	Very low	146 Å²	146	148.6 Å²	148.6	89%	0.885	82%	0.821	S	S	*	*			trans	-71.2	130	-178.9	177.8	0	0	0	0	111.6
304	V	28.7	Very low	30.1	Very low	136 Å²	136	144 Å²	144	82%	0.824	82%	0.817	S	S	*	*			trans	-115.3	135.5	166.8	178.7	0	0	0	0	108.6
305	A	27.4	Very low	30.2	Very low	87 Å²	87	144.3 Å²	144.3	72%	0.719	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-73.6	152.6	-175.8	0	0	0	0	0	113
306	P	32.7	Very low	29.9	Very low	128 Å²	128	144.4 Å²	144.4	83%	0.831	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-88.2	133.7	-176.9	33.6	-33.2	0	0	0	113.4
307	E	28.9	Very low	29.6	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-92	153.3	165.1	-78.7	-119.8	137.3	0	0	111.8
308	P	32.9	Very low	30	Very low	108 Å²	108	143.1 Å²	143.1	70%	0.701	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-81.7	163.5	-172.1	33.4	-36.5	0	0	0	114.5
309	P	31.3	Very low	29.9	Very low	133 Å²	133	139.8 Å²	139.8	86%	0.864	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.3	139.1	-169.7	32.9	-35.4	0	0	0	114.3
310	A	27.1	Very low	29.6	Very low	94 Å²	94	141.7 Å²	141.7	78%	0.777	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.7	148.6	166.9	0	0	0	0	0	111.6
311	P	29.5	Very low	29.4	Very low	130 Å²	130	139.3 Å²	139.3	84%	0.844	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-81.9	159.6	-166.5	32.2	-36.8	0	0	0	115.2
312	Q	31.6	Very low	29.1	Very low	184 Å²	184	137.9 Å²	137.9	86%	0.86	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.9	148.9	179.2	-59.2	-177.7	-5	0	0	113
313	L	27.9	Very low	28.8	Very low	180 Å²	180	138.1 Å²	138.1	94%	0.942	82%	0.819	S	S	*	*			trans	-138	147.7	159.6	-96.5	167.8	0	0	0	111.4
314	V	28.1	Very low	28.9	Very low	125 Å²	125	137.7 Å²	137.7	76%	0.758	81%	0.812	S	S	*	*			trans	-99.8	149.7	-164.8	171.3	0	0	0	0	110.5
315	P	31.8	Very low	28.9	Very low	117 Å²	117	140 Å²	140	76%	0.76	81%	0.814	S	S	*	*			trans	-85.3	152.8	-166.1	33.6	-37	0	0	0	114.7
316	L	24.3	Very low	28.9	Very low	169 Å²	169	141.6 Å²	141.6	89%	0.885	82%	0.815	S	S	*	*			trans	-138.2	144.3	167.7	-73.1	172.6	0	0	0	112
317	T	26	Very low	28.7	Very low	129 Å²	129	146.7 Å²	146.7	79%	0.791	82%	0.817	S	S	*	*			trans	-146.1	173.4	170.2	53.5	0	0	0	0	107
318	P	38.7	Very low	28.7	Very low	117 Å²	117	149.6 Å²	149.6	76%	0.76	82%	0.82	S	S	*	*			cis	-107.1	-141.4	-9.9	37.1	-17.6	0	0	0	107.9
319	P	32.1	Very low	28.6	Very low	116 Å²	116	148.9 Å²	148.9	75%	0.753	82%	0.818	S	S	*	*			cis	-129.7	-148.4	-6.1	43.3	-23.2	0	0	0	114.6
320	F	23.5	Very low	28.4	Very low	188 Å²	188	151.3 Å²	151.3	83%	0.825	82%	0.815	S	S	*	*			trans	-95.5	147.5	-167.7	-63.5	-101.7	0	0	0	114.5
321	L	24.5	Very low	28.5	Very low	176 Å²	176	153.2 Å²	153.2	92%	0.921	82%	0.821	S	S	*	*				-161.7	146	116.2	-105.7	169.4	0	0	0	110.5
322	V	25	Very low	28.5	Very low	131 Å²	131	158.2 Å²	158.2	79%	0.794	82%	0.823	S	S	*	*			trans	-101.4	137.2	-172	175.7	0	0	0	0	110.4
323	S	23.6	Very low	28.3	Very low	121 Å²	121	159.7 Å²	159.7	85%	0.846	82%	0.822	S	S	*	*			trans	-137.4	147.3	159.1	-166.6	0	0	0	0	110.8	Q325	S323-Q325 PolarHBondContact O-N 2.91Å
324	D	30.7	Very low	28.2	Very low	137 Å²	137	162.4 Å²	162.4	73%	0.733	82%	0.82	S	S	*	*	S	Bend	trans	-91.8	91.3	-158.4	-176.7	24.9	0	0	0	112.9
325	Q	29.2	Very low	28.3	Very low	185 Å²	185	161.8 Å²	161.8	86%	0.864	82%	0.82	S	S	*	*			trans	-154.8	31.9	169.5	-130.4	173.7	8.8	0	0	118.3	S323	S323-Q325 PolarHBondContact O-N 2.91Å
326	V	27.1	Very low	28	Very low	121 Å²	121	168.4 Å²	168.4	73%	0.733	83%	0.83	S	S	*	*			trans	-133.9	62.6	167.1	-165.1	0	0	0	0	112.3
327	R	29.2	Very low	28	Very low	234 Å²	234	169.8 Å²	169.8	88%	0.883	83%	0.829	S	S	*	*			trans	-100.9	31.8	177.4	-150.1	178.2	-178.7	-161.8	0.1	114.3
328	R	29.4	Very low	28.1	Very low	246 Å²	246	172 Å²	172	93%	0.928	83%	0.831	S	S	*	*	S	Bend	trans	-130.5	8.5	-179.8	-89.1	-172.6	174.3	176.9	-1	116.8
329	S	29.9	Very low	27.7	Very low	93 Å²	93	173.7 Å²	173.7	65%	0.65	83%	0.833	S	S	*	*	S	Bend	trans	-130.1	22.9	-175.5	-52.4	0	0	0	0	115.6
330	F	27.6	Very low	27.5	Very low	185 Å²	185	176 Å²	176	81%	0.811	84%	0.838	S	S	*	*			trans	-132.8	56.3	179	-96	-83	0	0	0	114
331	C	28.7	Very low	27.8	Very low	134 Å²	134	176.1 Å²	176.1	91%	0.905	84%	0.841	S	S	*	*			trans	-127.1	44.8	168.1	-79.5	0	0	0	0	112.8
332	R	30.7	Very low	27.9	Very low	234 Å²	234	174.4 Å²	174.4	88%	0.883	84%	0.838	S	S	*	*	S	Bend	trans	-129.9	-1.5	172.3	-90.4	-172.1	178	-180	0.1	116.5
333	Y	27.1	Very low	27.9	Very low	215 Å²	215	176.1 Å²	176.1	84%	0.843	84%	0.842	S	S	*	*	S	Bend	trans	-120.9	56	179.3	-80.2	-83.7	0	0	0	113.3
334	R	25.8	Very low	28	Very low	237 Å²	237	175.2 Å²	175.2	89%	0.894	84%	0.836	S	S	*	*			trans	-133.1	0.9	164.1	-86.9	-165	179.7	-166.8	1.4	115.2	W336	R334-W336 VanDerWaalsContact C-N 3.29Å; R334-W336 PolarHBondContact O-N 2.93Å
335	C	29.3	Very low	27.7	Very low	113 Å²	113	177.2 Å²	177.2	76%	0.764	84%	0.842	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	25.9	-177.8	-159.6	0	0	0	0	114.1
336	W	25.7	Very low	27.6	Very low	255 Å²	255	176.5 Å²	176.5	97%	0.966	84%	0.837	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	21.7	-175.2	-94	63.1	0	0	0	113.3	R334	R334-W336 VanDerWaalsContact C-N 3.29Å; R334-W336 PolarHBondContact O-N 2.93Å
337	K	25.1	Very low	27.5	Very low	199 Å²	199	177.2 Å²	177.2	87%	0.865	84%	0.842	S	S	*	*	S	Bend	trans	-145.7	27.1	179	-128.9	-175.8	-175.4	-170.8	0	116.2
338	Q	27.4	Very low	27.2	Very low	175 Å²	175	176.5 Å²	176.5	82%	0.818	84%	0.84	S	S	*	*	S	Bend	trans	-140.9	53.6	173.9	-78.9	-177.1	-47.9	0	0	111.1
339	N	30	Very low	27.2	Very low	152 Å²	152	172.2 Å²	172.2	81%	0.813	84%	0.836	S	S	*	*			trans	-143.6	37.2	170.5	-87.6	-42	0	0	0	111.2
340	L	29.2	Very low	26.9	Very low	165 Å²	165	174.3 Å²	174.3	86%	0.864	85%	0.845	S	S	*	*	S	Bend	trans	-123.6	140.2	157	-90.1	137.7	0	0	0	104.4
341	E	28.4	Very low	27	Very low	190 Å²	190	171.3 Å²	171.3	89%	0.888	84%	0.844	S	S	*	*			trans	75.1	67	-168.2	-54.5	177.2	179.4	0	0	115.7
342	V	26.6	Very low	26.9	Very low	140 Å²	140	174.4 Å²	174.4	85%	0.848	85%	0.845	S	S	*	*			trans	-132	73.5	143.4	-171.1	0	0	0	0	108.9
343	L	25.6	Very low	26.7	Very low	168 Å²	168	167 Å²	167	88%	0.88	83%	0.834	S	S	*	*	S	Bend	trans	-141	127.6	158.3	-146.5	95.3	0	0	0	107.3
344	S	25.7	Very low	26.7	Very low	102 Å²	102	164.7 Å²	164.7	71%	0.713	84%	0.835	S	S	*	*			trans	66	107	-172.7	-166.3	0	0	0	0	116.3
345	M	24.7	Very low	26.8	Very low	178 Å²	178	161.2 Å²	161.2	88%	0.877	83%	0.833	S	S	*	*				-150.5	106.7	127.5	-89.3	-149.7	73.2	0	0	109.2
346	F	25.7	Very low	26.6	Very low	171 Å²	171	163.3 Å²	163.3	75%	0.75	84%	0.836	S	S	*	*			trans	-68.8	134.9	162.4	-76.8	-99.7	0	0	0	108.9	Y348	F346-Y348 PolarHBondContact O-N 3.28Å; F346-Y348 VanDerWaalsContact O-N 3.16Å
347	T	26	Very low	26.8	Very low	136 Å²	136	155.3 Å²	155.3	83%	0.834	82%	0.817	S	S	*	*			trans	-75.9	100.7	179.4	46.9	0	0	0	0	111.2
348	Y	23.8	Very low	26.9	Very low	218 Å²	218	156.6 Å²	156.6	86%	0.855	82%	0.818	S	S	*	*			trans	-83.4	120.3	161.2	-83.3	-88	0	0	0	109.8	F346	F346-Y348 PolarHBondContact O-N 3.28Å; F346-Y348 VanDerWaalsContact O-N 3.16Å
349	N	27.6	Very low	27.1	Very low	157 Å²	157	155.6 Å²	155.6	84%	0.84	82%	0.818	S	S	*	*			trans	-73	136	171.7	-75.4	-39.9	0	0	0	110.7
350	V	25.1	Very low	27.1	Very low	136 Å²	136	158.5 Å²	158.5	82%	0.824	82%	0.823	S	S	*	*			trans	-129.4	126.2	160.1	-179.2	0	0	0	0	107.4
351	P	28.7	Very low	27	Very low	123 Å²	123	161.9 Å²	161.9	80%	0.799	83%	0.825	S	S	*	*			trans	-89.6	135.1	-169.4	31.6	-28.7	0	0	0	112
352	Q	27.2	Very low	27.1	Very low	199 Å²	199	158.7 Å²	158.7	93%	0.93	82%	0.818	S	S	*	*			trans	-101.8	99.2	173.8	-165.8	142.5	16	0	0	110.4
353	A	26.1	Very low	27.2	Very low	79 Å²	79	161.4 Å²	161.4	65%	0.653	82%	0.818	S	S	*	*			trans	-86.6	166.3	172.1	0	0	0	0	0	112
354	L	26.7	Very low	27.7	Very low	166 Å²	166	161.6 Å²	161.6	87%	0.869	82%	0.817	S	S	*	*			trans	75.2	113	177	-47.7	168.5	0	0	0	112.7
355	I	27.5	Very low	27.9	Very low	163 Å²	163	164.5 Å²	164.5	84%	0.836	82%	0.819	S	S	*	*				-150.7	137.3	58.4	-76.1	150.4	0	0	0	110.2
356	N	25.9	Very low	28.3	Very low	158 Å²	158	163.7 Å²	163.7	85%	0.845	82%	0.818	S	S	*	*			trans	-148.5	120	163.5	-168.9	3	0	0	0	109.7
357	P	29.6	Very low	28.6	Very low	86 Å²	86	163.9 Å²	163.9	56%	0.558	82%	0.819	S	S	*	*			trans	-102.8	142.5	-178.4	38	-31.8	0	0	0	113.6
358	Y	27.7	Very low	29.2	Very low	227 Å²	227	161.6 Å²	161.6	89%	0.89	81%	0.813	S	S	*	*			trans	83.1	90.4	167.9	-57.9	-68.8	0	0	0	119.8
359	L	31.5	Very low	29.8	Very low	154 Å²	154	157.1 Å²	157.1	81%	0.806	81%	0.809	S	S	*	*			trans	-35.9	135.8	147.4	-69.3	143	0	0	0	115
360	F	29.1	Very low	30.3	Very low	212 Å²	212	155.2 Å²	155.2	93%	0.93	80%	0.798	S	S	*	*				-151.6	101.7	126.2	-100.5	-74.9	0	0	0	109.2
361	R	28.6	Very low	31.3	Very low	237 Å²	237	153.5 Å²	153.5	89%	0.894	79%	0.788	S	S	*	*			trans	-92.5	100.7	175.3	-165.9	-178.7	-165	-150.5	3.5	109.2	K363	R361-K363 PolarHBondContact O-N 3.48Å
362	V	29.5	Very low	32.1	Very low	122 Å²	122	151.8 Å²	151.8	74%	0.739	78%	0.78	S	S	*	*			trans	-64	132.1	166	178.2	0	0	0	0	108.1	M364	V362-M364 HydrophobicContact CG1-CG 4.49Å; V362-M364 PolarHBondContact O-N 3.02Å
363	K	28.9	Very low	32.7	Very low	197 Å²	197	149 Å²	149	86%	0.857	77%	0.771	S	S	*	*			trans	-80.1	103.5	178.7	-158.8	-172.9	-173	-163.7	0	108	R361	R361-K363 PolarHBondContact O-N 3.48Å
364	M	36	Very low	33.2	Very low	173 Å²	173	151.5 Å²	151.5	85%	0.852	77%	0.773	S	S	*	*			trans	-97.1	133.3	168.8	-62.2	-134.7	-70.6	0	0	109	V362	V362-M364 HydrophobicContact CG1-CG 4.49Å; V362-M364 PolarHBondContact O-N 3.02Å
365	E	30.7	Very low	33.5	Very low	162 Å²	162	152.5 Å²	152.5	76%	0.757	77%	0.773	S	S	*	*			trans	-83.2	136.2	169.5	-71.1	179.2	152.6	0	0	108.8	K367	E365-K367 PolarHBondContact O-N 3.41Å
366	D	32.2	Very low	34	Very low	161 Å²	161	150.8 Å²	150.8	86%	0.861	77%	0.77	S	S	*	*			trans	-77.8	110.7	175.5	-156.6	1	0	0	0	108.7
367	K	32.8	Very low	34.3	Very low	175 Å²	175	151.1 Å²	151.1	76%	0.761	77%	0.766	S	S	*	*			trans	-101.7	76.3	171.4	-76.5	-169.3	176.7	-174.8	0	108.5	E365 V369	E365-K367 PolarHBondContact O-N 3.41Å; K367-V369 PolarHBondContact O-N 2.73Å; K367-V369 VanDerWaalsContact O-N 3.15Å
368	A	37.4	Very low	34.7	Very low	88 Å²	88	156.1 Å²	156.1	73%	0.727	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-56.8	117.3	159.6	0	0	0	0	0	108
369	V	36.9	Very low	35.3	Very low	124 Å²	124	149 Å²	149	75%	0.752	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-75.5	128.2	163	-178.8	0	0	0	0	105.5	K367 T371	K367-V369 PolarHBondContact O-N 2.73Å; K367-V369 VanDerWaalsContact O-N 3.15Å; V369-T371 PolarHBondContact O-N 2.69Å
370	D	37.2	Very low	35.7	Very low	117 Å²	117	147.4 Å²	147.4	63%	0.626	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.1	126.7	175.8	-162.7	-16.9	0	0	0	109.1	S372	D370-S372 VanDerWaalsContact CG-OG 3.27Å; D370-S372 VanDerWaalsContact OD1-CB 3.23Å; D370-S372 WeakPolarHBondContact OD1-CB 3.12Å; D370-S372 PolarHBondContact OD1-N 3.27Å; D370-S372 PolarHBondContact OD1-OG 3.19Å; D370-S372 PolarHBondContact OD2-OG 3.17Å
371	T	46.8	Very low	36.1	Very low	100 Å²	100	144.6 Å²	144.6	61%	0.613	75%	0.75	S	S	*	*			trans	-118.3	21.4	175.8	64.4	0	0	0	0	111.3	V369 D373 L374	V369-T371 PolarHBondContact O-N 2.69Å; T371-D373 PolarHBondContact O-N 3.31Å; T371-L374 PolarHBondContact O-N 2.73Å; T371-L374 VanDerWaalsContact O-N 3.15Å
372	S	44.9	Very low	36.6	Very low	88 Å²	88	135.7 Å²	135.7	62%	0.615	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-13.5	175.9	54.9	0	0	0	0	113.6	D370 L374	D370-S372 VanDerWaalsContact CG-OG 3.27Å; D370-S372 VanDerWaalsContact OD1-CB 3.23Å; D370-S372 WeakPolarHBondContact OD1-CB 3.12Å; D370-S372 PolarHBondContact OD1-N 3.27Å; D370-S372 PolarHBondContact OD1-OG 3.19Å; D370-S372 PolarHBondContact OD2-OG 3.17Å; S372-L374 PolarHBondContact O-N 2.88Å
373	D	41.5	Very low	37.2	Very low	141 Å²	141	135 Å²	135	75%	0.754	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-17.5	170.7	-48.6	32.1	0	0	0	114	T371 E375	T371-D373 PolarHBondContact O-N 3.31Å; D373-E375 PolarHBondContact O-N 2.89Å
374	L	36.1	Very low	37.6	Very low	131 Å²	131	134.7 Å²	134.7	69%	0.686	73%	0.725	S	S	*	*	S	Bend	trans	-92.6	92.5	176	-74.3	171.7	0	0	0	109.6	T371 S372 V376	T371-L374 PolarHBondContact O-N 2.73Å; T371-L374 VanDerWaalsContact O-N 3.15Å; S372-L374 PolarHBondContact O-N 2.88Å; L374-V376 PolarHBondContact O-N 3.42Å
375	E	33.8	Very low	37.8	Very low	187 Å²	187	129.7 Å²	129.7	87%	0.874	72%	0.717	S	S	*	*			trans	-57.2	102.1	163.9	-67.7	179.8	158.2	0	0	109	D373 E377	D373-E375 PolarHBondContact O-N 2.89Å; E375-E377 VanDerWaalsContact C-N 3.35Å; E375-E377 PolarHBondContact O-N 3.42Å
376	V	36.6	Very low	38.2	Very low	127 Å²	127	126.5 Å²	126.5	77%	0.77	71%	0.705	S	S	*	*			trans	-77.5	90.5	172.4	-178.8	0	0	0	0	107.7	L374 E378	L374-V376 PolarHBondContact O-N 3.42Å; V376-E378 PolarHBondContact O-N 2.88Å
377	E	33.3	Very low	38.8	Very low	164 Å²	164	121.5 Å²	121.5	77%	0.766	68%	0.678	S	S	*	*			trans	-49	133.9	155.1	-78.7	-82.3	130.6	0	0	108.9	E375 D379	E375-E377 VanDerWaalsContact C-N 3.35Å; E375-E377 PolarHBondContact O-N 3.42Å; E377-D379 PolarHBondContact O-N 3.34Å
378	E	38.3	Very low	39.3	Very low	191 Å²	191	118.3 Å²	118.3	89%	0.893	67%	0.669	S	S	*	*	S	Bend	trans	-63.7	131.2	-175.9	-68.7	-160.2	143.4	0	0	112.1	V376	V376-E378 PolarHBondContact O-N 2.88Å
379	D	39.9	Very low	39.6	Very low	78 Å²	78	115.7 Å²	115.7	42%	0.417	64%	0.642	S	S	.	*			trans	42.6	71.8	169.3	-166.1	12.5	0	0	0	117.4	E377 M381 G382 L383	E377-D379 PolarHBondContact O-N 3.34Å; D379-M381 PolarHBondContact O-N 2.91Å; D379-M381 PolarHBondContact OD1-N 2.89Å; D379-M381 VanDerWaalsContact OD1-N 3.09Å; D379-G382 VanDerWaalsContact CG-N 3.3Å; D379-G382 PolarHBondContact OD1-N 2.81Å; D379-G382 WeakPolarHBondContact OD2-CA 3.48Å; D379-G382 PolarHBondContact OD2-N 3.36Å; D379-L383 PolarHBondContact OD2-N 2.82Å; D379-L383 VanDerWaalsContact OD2-N 3.09Å
380	P	40.1	Very low	40.1	Very low	121 Å²	121	113.1 Å²	113.1	79%	0.786	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	8.8	169.6	32.1	-36.5	0	0	0	114
381	M	37.8	Very low	40.5	Very low	152 Å²	152	109.6 Å²	109.6	75%	0.749	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-2	-178.7	-72.6	-155.3	64	0	0	115.4	D379 L383	D379-M381 PolarHBondContact O-N 2.91Å; D379-M381 PolarHBondContact OD1-N 2.89Å; D379-M381 VanDerWaalsContact OD1-N 3.09Å; M381-L383 VanDerWaalsContact C-N 3.33Å; M381-L383 HydrophobicContact CB-CD1 4.33Å; M381-L383 PolarHBondContact O-N 3.32Å
382	G	38.9	Very low	40.4	Very low	51 Å²	51	106.9 Å²	106.9	53%	0.526	60%	0.602	S	S	.	*			trans	57.3	41.2	171.2	0	0	0	0	0	113.7	D379 H384	D379-G382 VanDerWaalsContact CG-N 3.3Å; D379-G382 PolarHBondContact OD1-N 2.81Å; D379-G382 WeakPolarHBondContact OD2-CA 3.48Å; D379-G382 PolarHBondContact OD2-N 3.36Å; G382-H384 PolarHBondContact O-N 3.32Å; G382-H384 VanDerWaalsContact O-N 3.07Å
383	L	40.3	Very low	40.5	Very low	107 Å²	107	105.8 Å²	105.8	56%	0.56	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-77.9	6.5	-166.9	-120.9	142.8	0	0	0	114.2	D379 M381 G385 I386	D379-L383 PolarHBondContact OD2-N 2.82Å; D379-L383 VanDerWaalsContact OD2-N 3.09Å; M381-L383 VanDerWaalsContact C-N 3.33Å; M381-L383 HydrophobicContact CB-CD1 4.33Å; M381-L383 PolarHBondContact O-N 3.32Å; L383-G385 PolarHBondContact O-N 3.09Å; L383-I386 HydrophobicContact CD2-CD1 3.61Å; L383-I386 HydrophobicContact CD2-CG1 4.29Å
384	H	39.1	Very low	40.7	Very low	191 Å²	191	103.8 Å²	103.8	88%	0.884	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-74.4	6.2	170.1	-97.6	87.6	0	0	0	115	G382	G382-H384 PolarHBondContact O-N 3.32Å; G382-H384 VanDerWaalsContact O-N 3.07Å
385	G	39.7	Very low	41	Very low	67 Å²	67	103.7 Å²	103.7	69%	0.691	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-99.7	-6.6	-178.2	0	0	0	0	0	116.8	L383 D387	L383-G385 PolarHBondContact O-N 3.09Å; G385-D387 PolarHBondContact O-N 3.06Å
386	I	39.8	Very low	41.4	Very low	95 Å²	95	98.3 Å²	98.3	49%	0.487	55%	0.554	S	S	.	*			trans	-87.3	102.2	-176.4	-51.6	-176.3	0	0	0	110.1	L383 T390 A391	L383-I386 HydrophobicContact CD2-CD1 3.61Å; L383-I386 HydrophobicContact CD2-CG1 4.29Å; I386-T390 HydrophobicContact CG2-CG2 4.12Å; I386-A391 HydrophobicContact CG2-CB 4.44Å
387	D	44.7	Very low	41.8	Very low	56 Å²	56	96.7 Å²	96.7	30%	0.299	54%	0.54	S	S	.	.			trans	-52.7	138.3	171.9	-179.7	5.5	0	0	0	111.3	G385 I389 T390 A391 P458	G385-D387 PolarHBondContact O-N 3.06Å; D387-I389 PolarHBondContact O-N 3.15Å; D387-I389 PolarHBondContact OD1-N 2.71Å; D387-I389 VanDerWaalsContact OD1-N 3.11Å; D387-I389 WeakPolarHBondContact OD2-CD1 3.32Å; D387-T390 WeakPolarHBondContact O-CA 3.47Å; D387-T390 WeakPolarHBondContact O-CB 3.39Å; D387-T390 PolarHBondContact O-N 3.19Å; D387-A391 PolarHBondContact O-N 3Å; D387-P458 WeakPolarHBondContact OD2-CB 3.48Å; D387-P458 WeakPolarHBondContact OD2-CG 3.33Å
388	L	42.1	Very low	42	Very low	109 Å²	109	91.2 Å²	91.2	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-52.1	-28.1	174.8	-166.3	73.8	0	0	0	112.1	T138 A392	T138-L388 HydrophobicContact CG2-CD2 4.28Å; L388-A392 VanDerWaalsContact O-CB 3.25Å; L388-A392 WeakPolarHBondContact O-CB 3.34Å; L388-A392 PolarHBondContact O-N 2.88Å
389	I	44.1	Very low	42	Very low	32 Å²	32	87 Å²	87	16%	0.164	51%	0.512	C	S	.	.	H	α-helix	trans	-74.7	-40	176.1	-60.7	158.1	0	0	0	111.5	D387 A392 L393 P458 F459	D387-I389 PolarHBondContact O-N 3.15Å; D387-I389 PolarHBondContact OD1-N 2.71Å; D387-I389 VanDerWaalsContact OD1-N 3.11Å; D387-I389 WeakPolarHBondContact OD2-CD1 3.32Å; I389-A392 PolarHBondContact O-N 3.15Å; I389-L393 HydrophobicContact CG2-CD1 4.33Å; I389-L393 WeakPolarHBondContact O-CB 3.36Å; I389-L393 WeakPolarHBondContact O-CG 3.42Å; I389-L393 PolarHBondContact O-N 3.22Å; I389-P458 HydrophobicContact CD1-CB 3.86Å; I389-P458 HydrophobicContact CD1-CG 4.2Å; I389-F459 HydrophobicContact CD1-CD1 3.81Å; I389-F459 HydrophobicContact CD1-CD2 4.3Å; I389-F459 HydrophobicContact CD1-CE1 3.33Å; I389-F459 HydrophobicContact CD1-CE2 3.86Å; I389-F459 HydrophobicContact CD1-CG 4.27Å; I389-F459 HydrophobicContact CD1-CZ 3.35Å; I389-F459 HydrophobicContact CG1-CD1 4.39Å; I389-F459 HydrophobicContact CG1-CE1 3.62Å; I389-F459 HydrophobicContact CG1-CZ 3.84Å; I389-F459 HydrophobicContact CG2-CD1 4.29Å; I389-F459 HydrophobicContact CG2-CE1 4.06Å
390	T	47	Very low	42.2	Very low	70 Å²	70	85.1 Å²	85.1	43%	0.429	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-42.5	171.3	-58.5	0	0	0	0	110.4	I386 D387 L393 L394	I386-T390 HydrophobicContact CG2-CG2 4.12Å; D387-T390 WeakPolarHBondContact O-CA 3.47Å; D387-T390 WeakPolarHBondContact O-CB 3.39Å; D387-T390 PolarHBondContact O-N 3.19Å; T390-L393 PolarHBondContact O-N 2.92Å; T390-L394 HydrophobicContact CG2-CD1 4.02Å; T390-L394 WeakPolarHBondContact O-CB 3.46Å; T390-L394 VanDerWaalsContact O-CG 3.25Å; T390-L394 WeakPolarHBondContact O-CG 3.25Å; T390-L394 PolarHBondContact O-N 3.19Å
391	A	46.9	Very low	41.9	Very low	43 Å²	43	85.4 Å²	85.4	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-42.3	172.7	0	0	0	0	0	112.1	I386 D387 L394 F395	I386-A391 HydrophobicContact CG2-CB 4.44Å; D387-A391 PolarHBondContact O-N 3Å; A391-L394 PolarHBondContact O-N 2.85Å; A391-F395 VanDerWaalsContact O-CB 3.25Å; A391-F395 WeakPolarHBondContact O-CB 3.3Å; A391-F395 PolarHBondContact O-N 3.29Å
392	A	44.2	Very low	42.2	Very low	44 Å²	44	82 Å²	82	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-39.4	177.1	0	0	0	0	0	112.9	L388 I389 F395 C396	L388-A392 VanDerWaalsContact O-CB 3.25Å; L388-A392 WeakPolarHBondContact O-CB 3.34Å; L388-A392 PolarHBondContact O-N 2.88Å; I389-A392 PolarHBondContact O-N 3.15Å; A392-F395 PolarHBondContact O-N 2.68Å; A392-C396 PolarHBondContact O-N 2.75Å; A392-C396 PolarHBondContact O-SG 2.63Å
393	L	45.6	Very low	42.2	Very low	64 Å²	64	81.5 Å²	81.5	34%	0.335	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-44.3	173.5	-75.6	168.1	0	0	0	111.2	I389 T390 F395 C396 L397 F482	I389-L393 HydrophobicContact CG2-CD1 4.33Å; I389-L393 WeakPolarHBondContact O-CB 3.36Å; I389-L393 WeakPolarHBondContact O-CG 3.42Å; I389-L393 PolarHBondContact O-N 3.22Å; T390-L393 PolarHBondContact O-N 2.92Å; L393-F395 VanDerWaalsContact C-N 3.29Å; L393-F395 PolarHBondContact O-N 2.89Å; L393-C396 PolarHBondContact O-N 3.46Å; L393-L397 WeakPolarHBondContact O-CB 3.44Å; L393-L397 WeakPolarHBondContact O-CD1 3.39Å; L393-L397 WeakPolarHBondContact O-CG 3.25Å; L393-L397 PolarHBondContact O-N 2.92Å; L393-F482 HydrophobicContact CD2-CZ 4.38Å
394	L	46.3	Very low	42.5	Very low	100 Å²	100	83.7 Å²	83.7	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-61.6	-36.2	173.2	-73.8	168.3	0	0	0	112.1	T390 A391 G398	T390-L394 HydrophobicContact CG2-CD1 4.02Å; T390-L394 WeakPolarHBondContact O-CB 3.46Å; T390-L394 VanDerWaalsContact O-CG 3.25Å; T390-L394 WeakPolarHBondContact O-CG 3.25Å; T390-L394 PolarHBondContact O-N 3.19Å; A391-L394 PolarHBondContact O-N 2.85Å; L394-G398 WeakPolarHBondContact O-CA 3.5Å; L394-G398 PolarHBondContact O-N 3.26Å
395	F	42.5	Very low	42.7	Very low	128 Å²	128	76.4 Å²	76.4	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-67.2	-49.2	174.9	-172.6	-100.6	0	0	0	111.5	A391 A392 L393 L397 G398 D399	A391-F395 VanDerWaalsContact O-CB 3.25Å; A391-F395 WeakPolarHBondContact O-CB 3.3Å; A391-F395 PolarHBondContact O-N 3.29Å; A392-F395 PolarHBondContact O-N 2.68Å; L393-F395 VanDerWaalsContact C-N 3.29Å; L393-F395 PolarHBondContact O-N 2.89Å; F395-L397 VanDerWaalsContact C-N 3.27Å; F395-L397 PolarHBondContact O-N 2.75Å; F395-G398 PolarHBondContact O-N 3.4Å; F395-G398 VanDerWaalsContact O-N 3.12Å; F395-D399 VanDerWaalsContact CZ-OD2 3.3Å; F395-D399 WeakPolarHBondContact CZ-OD2 3.15Å; F395-D399 WeakPolarHBondContact O-CB 3.33Å; F395-D399 PolarHBondContact O-N 3.34Å
396	C	43	Very low	42.8	Very low	74 Å²	74	80.5 Å²	80.5	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-58.5	-37.4	175	-70.3	0	0	0	0	113	A392 L393	A392-C396 PolarHBondContact O-N 2.75Å; A392-C396 PolarHBondContact O-SG 2.63Å; L393-C396 PolarHBondContact O-N 3.46Å
397	L	44.8	Very low	43.2	Very low	93 Å²	93	80.6 Å²	80.6	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-73.8	-37.6	174.7	-67.6	168.6	0	0	0	112.4	L393 F395	L393-L397 WeakPolarHBondContact O-CB 3.44Å; L393-L397 WeakPolarHBondContact O-CD1 3.39Å; L393-L397 WeakPolarHBondContact O-CG 3.25Å; L393-L397 PolarHBondContact O-N 2.92Å; F395-L397 VanDerWaalsContact C-N 3.27Å; F395-L397 PolarHBondContact O-N 2.75Å
398	G	38	Very low	43.2	Very low	50 Å²	50	80.6 Å²	80.6	52%	0.515	50%	0.497	S	S	.	.	H	α-helix	trans	-79.2	-37.5	-171.2	0	0	0	0	0	115.2	L394 F395 S400	L394-G398 WeakPolarHBondContact O-CA 3.5Å; L394-G398 PolarHBondContact O-N 3.26Å; F395-G398 PolarHBondContact O-N 3.4Å; F395-G398 VanDerWaalsContact O-N 3.12Å; G398-S400 PolarHBondContact O-N 3.39Å
399	D	37.9	Very low	43.7	Very low	102 Å²	102	78.4 Å²	78.4	55%	0.545	49%	0.491	S	S	.	.			trans	-78.3	61.3	-162.9	-124.2	33.2	0	0	0	114.1	F395 R479	F395-D399 VanDerWaalsContact CZ-OD2 3.3Å; F395-D399 WeakPolarHBondContact CZ-OD2 3.15Å; F395-D399 WeakPolarHBondContact O-CB 3.33Å; F395-D399 PolarHBondContact O-N 3.34Å; D399-R479 PolarHBondContact O-NH1 2.96Å; D399-R479 PolarHBondContact O-NH2 3.41Å
400	S	42.6	Very low	43.9	Very low	38 Å²	38	85 Å²	85	27%	0.266	51%	0.513	S	S	.	.			trans	-90.4	126.1	-169	-65.6	0	0	0	0	113	G398 G402 G403 R479	G398-S400 PolarHBondContact O-N 3.39Å; S400-G402 PolarHBondContact O-N 2.99Å; S400-G403 VanDerWaalsContact CB-N 3.3Å; S400-G403 PolarHBondContact O-N 3.17Å; S400-G403 VanDerWaalsContact O-N 3.08Å; S400-R479 VanDerWaalsContact CA-CZ 3.43Å; S400-R479 VanDerWaalsContact OG-CD 3.28Å; S400-R479 WeakPolarHBondContact OG-CD 3.48Å; S400-R479 PolarHBondContact OG-NH1 3.15Å; S400-R479 VanDerWaalsContact OG-NH1 3.17Å
401	P	35.4	Very low	43.9	Very low	128 Å²	128	87.9 Å²	87.9	83%	0.831	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	61.9	170.3	34	-36.2	0	0	0	110.1	R479	P401-R479 VanDerWaalsContact CD-NH2 3.31Å
402	G	43.4	Very low	44.3	Very low	79 Å²	79	90 Å²	90	81%	0.814	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	152.4	-7	-167.6	0	0	0	0	0	114.5	S400	S400-G402 PolarHBondContact O-N 2.99Å
403	G	39.5	Very low	44.2	Very low	42 Å²	42	94 Å²	94	43%	0.433	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-87.6	133.7	169.6	0	0	0	0	0	109.9	S400	S400-G403 VanDerWaalsContact CB-N 3.3Å; S400-G403 PolarHBondContact O-N 3.17Å; S400-G403 VanDerWaalsContact O-N 3.08Å
404	R	46.4	Very low	44.6	Very low	152 Å²	152	93.4 Å²	93.4	57%	0.574	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-78.6	132.6	177.1	-60	180	-177.6	-136.3	8.5	108.6	D418	R404-D418 IonicContact CZ-OD2 3.74Å; R404-D418 IonicContact NH1-OD2 3.35Å; R404-D418 PolarHBondContact NH1-OD2 3.29Å; R404-D418 IonicContact NH2-OD2 3.53Å; R404-D418 PolarHBondContact NH2-OD2 2.77Å
405	G	42.8	Very low	44.2	Very low	39 Å²	39	98.8 Å²	98.8	40%	0.402	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-62.3	144.6	168	0	0	0	0	0	110.1	S407 D408	G405-S407 PolarHBondContact O-N 3.34Å; G405-D408 WeakPolarHBondContact O-CB 3.27Å; G405-D408 PolarHBondContact O-N 3.11Å
406	I	42.1	Very low	44	Very low	153 Å²	153	99.2 Å²	99.2	79%	0.785	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	128.4	171.5	-61.2	173	0	0	0	107.2	D408	I406-D408 PolarHBondContact O-N 2.99Å
407	S	48	Very low	44.3	Very low	96 Å²	96	99.4 Å²	99.4	67%	0.671	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.9	9.8	-175.1	-47.5	0	0	0	0	116.2	G405 S409	G405-S407 PolarHBondContact O-N 3.34Å; S407-S409 PolarHBondContact O-N 2.71Å
408	D	45.1	Very low	44	Very low	56 Å²	56	98.5 Å²	98.5	30%	0.299	56%	0.563	S	S	.	*			trans	-64.2	127	168.1	-166.9	1.3	0	0	0	108.6	G405 I406 R410 G420	G405-D408 WeakPolarHBondContact O-CB 3.27Å; G405-D408 PolarHBondContact O-N 3.11Å; I406-D408 PolarHBondContact O-N 2.99Å; D408-R410 IonicContact OD1-NE 2.65Å; D408-R410 PolarHBondContact OD1-NE 3.34Å; D408-R410 IonicContact OD1-NH2 2.7Å; D408-R410 IonicContact OD2-CZ 3.77Å; D408-R410 IonicContact OD2-NE 3.64Å; D408-R410 PolarHBondContact OD2-NE 3.26Å; D408-R410 IonicContact OD2-NH2 2.95Å; D408-R410 PolarHBondContact OD2-NH2 3.04Å; D408-G420 PolarHBondContact O-N 3.38Å
409	S	52.1	Low	44.4	Very low	64 Å²	64	102.4 Å²	102.4	45%	0.448	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.5	117	-176.1	60.3	0	0	0	0	108.9	S407	S407-S409 PolarHBondContact O-N 2.71Å
410	R	48.8	Very low	44.6	Very low	170 Å²	170	98.1 Å²	98.1	64%	0.642	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.1	-177.6	-61.8	-167.4	-168.6	-161.8	6	111.5	D408 V412 D418	D408-R410 IonicContact OD1-NE 2.65Å; D408-R410 PolarHBondContact OD1-NE 3.34Å; D408-R410 IonicContact OD1-NH2 2.7Å; D408-R410 IonicContact OD2-CZ 3.77Å; D408-R410 IonicContact OD2-NE 3.64Å; D408-R410 PolarHBondContact OD2-NE 3.26Å; D408-R410 IonicContact OD2-NH2 2.95Å; D408-R410 PolarHBondContact OD2-NH2 3.04Å; R410-V412 PolarHBondContact O-N 3.45Å; R410-D418 PolarHBondContact N-O 2.93Å; R410-D418 PolarHBondContact O-N 3.35Å; R410-D418 VanDerWaalsContact O-N 3.09Å
411	F	47.7	Very low	44.6	Very low	131 Å²	131	102.6 Å²	102.6	58%	0.575	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.7	115.8	170.4	-69.8	-92.6	0	0	0	108.9	H416 I417	F411-H416 VanDerWaalsContact CA-O 3.32Å; F411-H416 WeakPolarHBondContact CA-O 3.28Å; F411-I417 HydrophobicContact CD1-CG1 3.79Å; F411-I417 HydrophobicContact CD2-CG1 4.27Å; F411-I417 HydrophobicContact CE1-CD1 3.88Å; F411-I417 HydrophobicContact CE1-CG1 3.48Å; F411-I417 VanDerWaalsContact CE1-CG1 3.48Å; F411-I417 HydrophobicContact CE2-CD1 4.06Å; F411-I417 HydrophobicContact CE2-CG1 3.98Å; F411-I417 HydrophobicContact CG-CG1 4.19Å; F411-I417 HydrophobicContact CZ-CD1 3.55Å; F411-I417 HydrophobicContact CZ-CG1 3.58Å
412	V	53.3	Low	45	Very low	86 Å²	86	102.4 Å²	102.4	52%	0.521	56%	0.559	S	S	.	*	S	Bend	trans	-75.3	-48.8	178.3	-177.9	0	0	0	0	109.9	R410 H416 D418	R410-V412 PolarHBondContact O-N 3.45Å; V412-H416 PolarHBondContact N-O 2.79Å; V412-D418 HydrophobicContact CG2-CB 3.67Å
413	D	43.9	Very low	44.5	Very low	128 Å²	128	105.6 Å²	105.6	68%	0.684	56%	0.563	S	S	*	*	S	Bend	trans	-137.2	47.1	-179.1	-69.5	-60.3	0	0	0	111.8	Y415	D413-Y415 PolarHBondContact O-N 2.76Å
414	G	52.1	Low	44.3	Very low	53 Å²	53	110.2 Å²	110.2	55%	0.546	57%	0.572	S	S	.	*	S	Bend	trans	70.7	-21.4	171.8	0	0	0	0	0	117.7
415	Y	39.7	Very low	43.3	Very low	212 Å²	212	108.6 Å²	108.6	83%	0.831	58%	0.583	S	S	*	*	S	Bend	trans	-120.8	-9.9	-178.8	-69.6	-82.1	0	0	0	114.8	D413	D413-Y415 PolarHBondContact O-N 2.76Å
416	H	37.3	Very low	42.8	Very low	137 Å²	137	114.7 Å²	114.7	63%	0.634	60%	0.599	S	S	*	*			trans	-125.1	123.7	-178.6	-57.3	98.5	0	0	0	110	F411 V412	F411-H416 VanDerWaalsContact CA-O 3.32Å; F411-H416 WeakPolarHBondContact CA-O 3.28Å; V412-H416 PolarHBondContact N-O 2.79Å
417	I	49	Very low	42.2	Very low	78 Å²	78	112.9 Å²	112.9	40%	0.4	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	118	172.3	-58.7	172.8	0	0	0	107.6	F411 F419	F411-I417 HydrophobicContact CD1-CG1 3.79Å; F411-I417 HydrophobicContact CD2-CG1 4.27Å; F411-I417 HydrophobicContact CE1-CD1 3.88Å; F411-I417 HydrophobicContact CE1-CG1 3.48Å; F411-I417 VanDerWaalsContact CE1-CG1 3.48Å; F411-I417 HydrophobicContact CE2-CD1 4.06Å; F411-I417 HydrophobicContact CE2-CG1 3.98Å; F411-I417 HydrophobicContact CG-CG1 4.19Å; F411-I417 HydrophobicContact CZ-CD1 3.55Å; F411-I417 HydrophobicContact CZ-CG1 3.58Å; I417-F419 HydrophobicContact CB-CE2 4.41Å; I417-F419 HydrophobicContact CG2-CD2 4.44Å; I417-F419 HydrophobicContact CG2-CE1 4.27Å; I417-F419 HydrophobicContact CG2-CE2 3.96Å; I417-F419 HydrophobicContact CG2-CZ 3.87Å
418	D	38.7	Very low	41.3	Very low	75 Å²	75	114.8 Å²	114.8	40%	0.401	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.3	129.4	174.3	-140	22.9	0	0	0	108.3	R404 R410 V412	R404-D418 IonicContact CZ-OD2 3.74Å; R404-D418 IonicContact NH1-OD2 3.35Å; R404-D418 PolarHBondContact NH1-OD2 3.29Å; R404-D418 IonicContact NH2-OD2 3.53Å; R404-D418 PolarHBondContact NH2-OD2 2.77Å; R410-D418 PolarHBondContact N-O 2.93Å; R410-D418 PolarHBondContact O-N 3.35Å; R410-D418 VanDerWaalsContact O-N 3.09Å; V412-D418 HydrophobicContact CG2-CB 3.67Å
419	F	47.3	Very low	40.9	Very low	132 Å²	132	115.9 Å²	115.9	58%	0.579	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.7	122.7	176.4	-67.2	-85.7	0	0	0	109.6	I417 T421	I417-F419 HydrophobicContact CB-CE2 4.41Å; I417-F419 HydrophobicContact CG2-CD2 4.44Å; I417-F419 HydrophobicContact CG2-CE1 4.27Å; I417-F419 HydrophobicContact CG2-CE2 3.96Å; I417-F419 HydrophobicContact CG2-CZ 3.87Å; F419-T421 PolarHBondContact O-N 2.94Å
420	G	41.9	Very low	40.1	Very low	11 Å²	11	120.6 Å²	120.6	11%	0.113	65%	0.646	C	S	.	*			trans	-68.6	99.2	176.2	0	0	0	0	0	112.5	D408	D408-G420 PolarHBondContact O-N 3.38Å
421	T	41.9	Very low	39.2	Very low	133 Å²	133	120.1 Å²	120.1	82%	0.816	66%	0.656	S	S	*	*			trans	-105.5	117	166.6	53.5	0	0	0	0	110.2	F419	F419-T421 PolarHBondContact O-N 2.94Å
422	Q	43.2	Very low	38.3	Very low	123 Å²	123	118.7 Å²	118.7	58%	0.575	67%	0.668	S	S	*	*			trans	-122.9	110.6	169.9	-174.4	170.7	6	0	0	109.7	F424	Q422-F424 HydrophobicContact CG-CD2 3.92Å; Q422-F424 HydrophobicContact CG-CE2 3.92Å; Q422-F424 VanDerWaalsContact NE2-CE2 3.33Å; Q422-F424 VanDerWaalsContact NE2-CZ 3.33Å; Q422-F424 PolarHBondContact O-N 3.35Å; Q422-F424 VanDerWaalsContact O-N 3.17Å
423	T	34.1	Very low	37.2	Very low	146 Å²	146	119.5 Å²	119.5	90%	0.896	67%	0.673	S	S	*	*			trans	-79.6	88.3	169.6	37	0	0	0	0	109.9	S425	T423-S425 PolarHBondContact O-N 3.03Å
424	F	34.1	Very low	36.9	Very low	139 Å²	139	121.6 Å²	121.6	61%	0.61	68%	0.684	S	S	*	*			trans	-67.9	121.7	159.3	-84.1	-82	0	0	0	109.1	Q422 F426	Q422-F424 HydrophobicContact CG-CD2 3.92Å; Q422-F424 HydrophobicContact CG-CE2 3.92Å; Q422-F424 VanDerWaalsContact NE2-CE2 3.33Å; Q422-F424 VanDerWaalsContact NE2-CZ 3.33Å; Q422-F424 PolarHBondContact O-N 3.35Å; Q422-F424 VanDerWaalsContact O-N 3.17Å; F424-F426 HydrophobicContact CB-CE2 4.32Å; F424-F426 HydrophobicContact CB-CZ 4.44Å; F424-F426 PolarHBondContact O-N 3.19Å; F424-F426 VanDerWaalsContact O-N 3.1Å
425	S	26.3	Very low	36	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	69%	0.692	S	S	*	*			trans	-75.9	91.4	166.3	56.1	0	0	0	0	109	T423	T423-S425 PolarHBondContact O-N 3.03Å
426	F	31.3	Very low	36.1	Very low	167 Å²	167	123.5 Å²	123.5	73%	0.732	70%	0.697	S	S	*	*			trans	-59.7	143.2	166.2	-62.3	-82.7	0	0	0	109.6	F424 S428	F424-F426 HydrophobicContact CB-CE2 4.32Å; F424-F426 HydrophobicContact CB-CZ 4.44Å; F424-F426 PolarHBondContact O-N 3.19Å; F424-F426 VanDerWaalsContact O-N 3.1Å; F426-S428 PolarHBondContact O-N 3.04Å
427	P	29.7	Very low	35.8	Very low	115 Å²	115	124 Å²	124	75%	0.747	71%	0.709	S	S	*	*			trans	-55.3	131.5	165.9	-21.5	32.9	0	0	0	109.3	A429	P427-A429 PolarHBondContact O-N 2.95Å
428	S	29.6	Very low	34.9	Very low	136 Å²	136	123.7 Å²	123.7	95%	0.951	73%	0.726	S	S	*	*	S	Bend	trans	-71.9	72.3	-176	-53.6	0	0	0	0	112.3	F426	F426-S428 PolarHBondContact O-N 3.04Å
429	A	36.9	Very low	34.9	Very low	79 Å²	79	127.4 Å²	127.4	65%	0.653	75%	0.746	S	S	*	*			trans	-155	42.2	179.6	0	0	0	0	0	113.3	P427	P427-A429 PolarHBondContact O-N 2.95Å
430	I	34.5	Very low	34.2	Very low	164 Å²	164	129.4 Å²	129.4	84%	0.841	76%	0.761	S	S	*	*	S	Bend	trans	-152.8	83.1	148.5	-69.4	106.2	0	0	0	106.3
431	L	30.5	Very low	33.7	Very low	160 Å²	160	133.7 Å²	133.7	84%	0.838	79%	0.794	S	S	*	*			trans	-154.1	79.4	161.4	-81.1	-171.5	0	0	0	108.2	T433	L431-T433 VanDerWaalsContact C-N 3.32Å; L431-T433 PolarHBondContact O-N 3.18Å; L431-T433 VanDerWaalsContact O-N 3.12Å
432	A	28.6	Very low	33.2	Very low	101 Å²	101	133 Å²	133	84%	0.835	80%	0.795	S	S	*	*			trans	-79.5	82.5	168	0	0	0	0	0	109.1	N434	A432-N434 PolarHBondContact O-N 2.88Å
433	T	30.5	Very low	32.5	Very low	102 Å²	102	132 Å²	132	63%	0.626	81%	0.808	S	S	*	*			trans	-77.1	115	171.7	49.8	0	0	0	0	109.7	L431 T435	L431-T433 VanDerWaalsContact C-N 3.32Å; L431-T433 PolarHBondContact O-N 3.18Å; L431-T433 VanDerWaalsContact O-N 3.12Å; T433-T435 PolarHBondContact O-N 3.45Å
434	N	37.2	Very low	32.2	Very low	172 Å²	172	129.5 Å²	129.5	92%	0.92	80%	0.796	S	S	*	*			trans	-69.9	71.1	177.2	-93.4	-12.6	0	0	0	112.5	A432	A432-N434 PolarHBondContact O-N 2.88Å
435	T	34.6	Very low	32	Very low	115 Å²	115	127.8 Å²	127.8	71%	0.706	81%	0.808	S	S	*	*			trans	-115.7	95.2	169.9	52.4	0	0	0	0	109.9	T433 V437	T433-T435 PolarHBondContact O-N 3.45Å; T435-V437 PolarHBondContact O-N 2.93Å
436	M	40.2	Very low	32.4	Very low	191 Å²	191	127.6 Å²	127.6	94%	0.941	81%	0.806	S	S	*	*			trans	-67.8	112.1	174.3	-72.1	-170.1	-79.1	0	0	111.4
437	V	31.5	Very low	32.3	Very low	146 Å²	146	126.3 Å²	126.3	89%	0.885	81%	0.806	S	S	*	*			trans	-149.1	118.6	153.8	-174.2	0	0	0	0	110.8	T435	T435-V437 PolarHBondContact O-N 2.93Å
438	G	30.9	Very low	32.3	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	82%	0.816	S	S	*	*			trans	96.3	113.8	148.8	0	0	0	0	0	117.8
439	D	37.9	Very low	32.5	Very low	153 Å²	153	128.7 Å²	128.7	82%	0.818	81%	0.808	S	S	*	*			trans	-64.7	149.3	168.4	-64.3	-64.1	0	0	0	112.8
440	I	33.9	Very low	32.1	Very low	174 Å²	174	130.4 Å²	130.4	89%	0.892	82%	0.815	S	S	*	*			trans	118.8	57.5	173.1	-59.2	155.4	0	0	0	112.8
441	A	31	Very low	32.1	Very low	100 Å²	100	127.7 Å²	127.7	83%	0.826	81%	0.808	S	S	*	*			trans	-162.3	36.1	158.3	0	0	0	0	0	113.2
442	S	30.7	Very low	32.2	Very low	119 Å²	119	129 Å²	129	83%	0.832	81%	0.81	S	S	*	*			trans	-102.1	101.4	-176.1	-57.5	0	0	0	0	111.9
443	A	27.7	Very low	32.1	Very low	101 Å²	101	131.7 Å²	131.7	84%	0.835	81%	0.81	S	S	*	*			trans	-141	89.9	169.9	0	0	0	0	0	111.1
444	S	28.8	Very low	31.8	Very low	94 Å²	94	131.8 Å²	131.8	66%	0.657	82%	0.815	S	S	*	*			trans	33.7	102.3	168.5	-158.6	0	0	0	0	119.4
445	A	30.8	Very low	31.3	Very low	104 Å²	104	131.4 Å²	131.4	86%	0.86	81%	0.813	S	S	*	*	S	Bend	trans	-126.7	49	153.9	0	0	0	0	0	110.2
446	C	33.8	Very low	31.2	Very low	114 Å²	114	130.5 Å²	130.5	77%	0.77	81%	0.809	S	S	*	*			trans	-167.3	89.8	170	-104.2	0	0	0	0	109.5
447	D	29.5	Very low	30.9	Very low	140 Å²	140	123.9 Å²	123.9	75%	0.749	78%	0.781	S	S	*	*			trans	-170.4	66.5	160.4	-101.5	-23.5	0	0	0	110
448	H	30.2	Very low	31.1	Very low	204 Å²	204	120.4 Å²	120.4	94%	0.944	76%	0.762	S	S	*	*			trans	-168.2	67.5	158.8	-82.8	-36.8	0	0	0	110.9
449	A	32.7	Very low	31.5	Very low	96 Å²	96	118.3 Å²	118.3	79%	0.793	73%	0.732	S	S	*	*			trans	-110.5	129.8	150.8	0	0	0	0	0	104.6
450	S	28.3	Very low	31.8	Very low	115 Å²	115	116.5 Å²	116.5	80%	0.804	72%	0.718	S	S	*	*			cis	-168	-177	33.8	-96.2	0	0	0	0	106.6
451	P	35.3	Very low	32.8	Very low	107 Å²	107	113 Å²	113	70%	0.695	71%	0.705	S	S	*	*			cis	-141.5	173.2	20.8	43.4	-24.3	0	0	0	117.3
452	Q	31.8	Very low	34.5	Very low	188 Å²	188	109.6 Å²	109.6	88%	0.879	67%	0.673	S	S	*	*			trans	49.8	67	155.6	-62.2	-71.5	12.2	0	0	116.8
453	L	26.4	Very low	36.6	Very low	158 Å²	158	106.1 Å²	106.1	83%	0.827	64%	0.642	S	S	*	*			trans	-117	125.2	156.8	-90.6	159.2	0	0	0	109.6	N455	L453-N455 PolarHBondContact O-N 3.29Å
454	S	25.3	Very low	39.1	Very low	104 Å²	104	101.3 Å²	101.3	73%	0.727	60%	0.602	S	S	*	*			trans	-48.8	131.3	170.8	33.4	0	0	0	0	110.7	P456	S454-P456 VanDerWaalsContact O-CD 3.23Å; S454-P456 WeakPolarHBondContact O-CD 3.33Å
455	N	26.7	Very low	41.7	Very low	164 Å²	164	100 Å²	100	88%	0.877	59%	0.585	S	S	*	*			trans	-43.2	109.2	177.5	-100.4	-19.2	0	0	0	110.6	L453 S457	L453-N455 PolarHBondContact O-N 3.29Å; N455-S457 PolarHBondContact O-N 2.9Å; N455-S457 VanDerWaalsContact O-N 3.14Å
456	P	30.9	Very low	44.2	Very low	95 Å²	95	96.1 Å²	96.1	62%	0.617	55%	0.55	S	S	*	*			trans	-66.1	120.9	175.2	26.6	-31.6	0	0	0	107	S454	S454-P456 VanDerWaalsContact O-CD 3.23Å; S454-P456 WeakPolarHBondContact O-CD 3.33Å
457	S	34	Very low	46.6	Very low	53 Å²	53	94.2 Å²	94.2	37%	0.371	53%	0.534	S	S	.	.			trans	-47.5	137	-172.3	-172.6	0	0	0	0	112.3	N455 F459 H460	N455-S457 PolarHBondContact O-N 2.9Å; N455-S457 VanDerWaalsContact O-N 3.14Å; S457-F459 PolarHBondContact O-N 3.42Å; S457-F459 VanDerWaalsContact OG-CD2 3.3Å; S457-F459 WeakPolarHBondContact OG-CD2 3.43Å; S457-H460 PolarHBondContact O-N 3.48Å; S457-H460 PolarHBondContact O-ND1 3.45Å
458	P	37.1	Very low	49.2	Very low	72 Å²	72	88.9 Å²	88.9	47%	0.468	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-59.6	-15.5	-172.3	-23.3	32.2	0	0	0	114.9	D387 I389 H460	D387-P458 WeakPolarHBondContact OD2-CB 3.48Å; D387-P458 WeakPolarHBondContact OD2-CG 3.33Å; I389-P458 HydrophobicContact CD1-CB 3.86Å; I389-P458 HydrophobicContact CD1-CG 4.2Å; P458-H460 PolarHBondContact O-N 2.91Å
459	F	38.2	Very low	51.6	Low	30 Å²	30	82.6 Å²	82.6	13%	0.132	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-66.4	-5.7	175.7	-62.2	-61.5	0	0	0	115.9	L131 L134 I389 S457 T461	L131-F459 HydrophobicContact CD1-CB 4.3Å; L131-F459 HydrophobicContact CD2-CB 3.7Å; L131-F459 HydrophobicContact CD2-CD1 3.66Å; L131-F459 HydrophobicContact CD2-CG 3.86Å; L134-F459 HydrophobicContact CB-CE1 4.36Å; L134-F459 HydrophobicContact CD1-CE1 4.27Å; I389-F459 HydrophobicContact CD1-CD1 3.81Å; I389-F459 HydrophobicContact CD1-CD2 4.3Å; I389-F459 HydrophobicContact CD1-CE1 3.33Å; I389-F459 HydrophobicContact CD1-CE2 3.86Å; I389-F459 HydrophobicContact CD1-CG 4.27Å; I389-F459 HydrophobicContact CD1-CZ 3.35Å; I389-F459 HydrophobicContact CG1-CD1 4.39Å; I389-F459 HydrophobicContact CG1-CE1 3.62Å; I389-F459 HydrophobicContact CG1-CZ 3.84Å; I389-F459 HydrophobicContact CG2-CD1 4.29Å; I389-F459 HydrophobicContact CG2-CE1 4.06Å; S457-F459 PolarHBondContact O-N 3.42Å; S457-F459 VanDerWaalsContact OG-CD2 3.3Å; S457-F459 WeakPolarHBondContact OG-CD2 3.43Å; F459-T461 VanDerWaalsContact C-N 3.25Å; F459-T461 PolarHBondContact O-N 2.99Å
460	H	45.3	Very low	53.5	Low	114 Å²	114	83.2 Å²	83.2	53%	0.528	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-66.8	-20	-176.2	-80.9	92.4	0	0	0	114.9	S457 P458 R463	S457-H460 PolarHBondContact O-N 3.48Å; S457-H460 PolarHBondContact O-ND1 3.45Å; P458-H460 PolarHBondContact O-N 2.91Å; H460-R463 PolarHBondContact O-NH2 3.08Å
461	T	55	Low	55.6	Low	100 Å²	100	79 Å²	79	61%	0.613	44%	0.444	S	S	*	.	S	Bend	trans	-89.8	-28.7	-173.6	49.9	0	0	0	0	114.5	H102 F459 R463	H102-T461 PolarHBondContact NE2-O 3.27Å; F459-T461 VanDerWaalsContact C-N 3.25Å; F459-T461 PolarHBondContact O-N 2.99Å; T461-R463 PolarHBondContact O-N 2.79Å
462	L	65.2	Low	57.2	Low	29 Å²	29	75.1 Å²	75.1	15%	0.152	42%	0.421	C	S	.	.			trans	-69.4	122.1	-179.8	-175.8	65.8	0	0	0	110.2	P96 Q127 L130	P96-L462 HydrophobicContact CB-CD1 4.14Å; Q127-L462 VanDerWaalsContact CD-O 3.32Å; Q127-L462 PolarHBondContact NE2-O 3.35Å; L130-L462 HydrophobicContact CD2-CD2 3.77Å; L130-L462 HydrophobicContact CG-CD2 4.49Å
463	R	75	Confident	58.7	Low	47 Å²	47	74.1 Å²	74.1	18%	0.177	41%	0.409	C	S	.	.			trans	-125.1	153.8	173.8	-58.6	-60.3	-176.4	-155.7	-3.6	109.5	P96 V97 Y105 Q127 H460 T461	P96-R463 CarbonylContact C-O 3.57Å; P96-R463 VanDerWaalsContact CA-O 3.32Å; P96-R463 WeakPolarHBondContact CA-O 3.37Å; V97-R463 HydrophobicContact CB-CB 3.95Å; V97-R463 HydrophobicContact CG2-CB 3.64Å; V97-R463 PolarHBondContact N-O 2.81Å; Y105-R463 HydrophobicContact CD1-CB 4.06Å; Y105-R463 HydrophobicContact CD1-CG 3.82Å; Y105-R463 HydrophobicContact CE1-CB 4.06Å; Y105-R463 HydrophobicContact CE1-CG 4.01Å; Y105-R463 HydrophobicContact CG-CB 4.37Å; Y105-R463 HydrophobicContact CG-CG 4.44Å; Q127-R463 VanDerWaalsContact NE2-NH1 3.12Å; H460-R463 PolarHBondContact O-NH2 3.08Å; T461-R463 PolarHBondContact O-N 2.79Å
464	L	81.4	Confident	60.8	Low	0 Å²	0	76.3 Å²	76.3	0%	0	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-110.3	142.5	177	-60.4	177.9	0	0	0	110.6	R94 W95 V97 Y105 D126 Q127 L130 F482 F484	R94-L464 HydrophobicContact CB-CB 4.3Å; W95-L464 WeakPolarHBondContact O-CA 3.46Å; V97-L464 VanDerWaalsContact CG2-C 3.46Å; Y105-L464 WeakPolarHBondContact CE2-O 3.11Å; D126-L464 HydrophobicContact CB-CD1 3.9Å; Q127-L464 HydrophobicContact CB-CD1 4.14Å; Q127-L464 HydrophobicContact CB-CG 4.42Å; L130-L464 HydrophobicContact CD2-CD1 4.46Å; L130-L464 HydrophobicContact CD2-CD2 4.02Å; L464-F482 HydrophobicContact CD2-CD2 3.63Å; L464-F482 HydrophobicContact CD2-CE2 4.19Å; L464-F482 HydrophobicContact CD2-CG 4.4Å; L464-F484 HydrophobicContact CD1-CE1 4.37Å; L464-F484 HydrophobicContact CD1-CE2 3.94Å; L464-F484 HydrophobicContact CD1-CZ 3.48Å; L464-F484 VanDerWaalsContact CD1-CZ 3.48Å
465	E	83.1	Confident	62.8	Low	65 Å²	65	76.4 Å²	76.4	30%	0.304	40%	0.396	S	S	.	.			trans	-62.8	149	176.5	-71	-169.6	164.6	0	0	112.4	R94 W95 V97 V467	R94-E465 WeakPolarHBondContact CD-O 3.33Å; R94-E465 PolarHBondContact NH1-O 3.48Å; W95-E465 HydrophobicContact CB-CG 4.08Å; W95-E465 PolarHBondContact O-N 2.94Å; V97-E465 HydrophobicContact CG2-CG 4.24Å; E465-V467 VanDerWaalsContact C-N 3.33Å
466	L	83.3	Confident	64.5	Low	24 Å²	24	75.2 Å²	75.2	13%	0.126	40%	0.396	C	S	.	.	S	Bend	trans	-71.2	-28.5	179.4	-57.9	-175.7	0	0	0	112.9	R94 Y105 D119 M120 A123	R94-L466 PolarHBondContact NH1-O 3.33Å; Y105-L466 HydrophobicContact CE2-CD2 3.87Å; Y105-L466 HydrophobicContact CE2-CG 4.29Å; D119-L466 HydrophobicContact CB-CB 4.44Å; M120-L466 HydrophobicContact CB-CD2 4.35Å; M120-L466 HydrophobicContact CE-CD1 4.38Å; M120-L466 HydrophobicContact CE-CD2 3.93Å; M120-L466 HydrophobicContact SD-CD2 3.99Å; A123-L466 HydrophobicContact CB-CD2 3.63Å
467	V	84.1	Confident	66.1	Low	73 Å²	73	73.3 Å²	73.3	44%	0.442	38%	0.378	S	S	.	.	S	Bend	trans	-72.2	136.5	178.7	-177.3	0	0	0	0	110.2	E465	E465-V467 VanDerWaalsContact C-N 3.33Å
468	L	84.6	Confident	67.4	Low	28 Å²	28	77 Å²	77	15%	0.147	39%	0.389	C	S	.	.			trans	-94.7	133.1	172.6	-69.6	78.8	0	0	0	109.5	W92 L122 H507 L510	W92-L468 HydrophobicContact CB-CD2 4.09Å; W92-L468 HydrophobicContact CG-CD2 3.92Å; L122-L468 HydrophobicContact CD2-CD1 4.3Å; L122-L468 HydrophobicContact CD2-CD2 3.94Å; L468-H507 HydrophobicContact CD2-CB 3.91Å; L468-L510 HydrophobicContact CD1-CB 4.04Å; L468-L510 HydrophobicContact CD1-CD1 4.27Å
469	E	81.3	Confident	68.4	Low	72 Å²	72	78.6 Å²	78.6	34%	0.336	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-106.9	136	169.3	-72.3	-159.2	-173.5	0	0	112.1	N93 W95 M481	N93-E469 HydrophobicContact CB-CB 4.38Å; N93-E469 WeakPolarHBondContact CB-O 3.46Å; N93-E469 PolarHBondContact N-O 2.88Å; N93-E469 PolarHBondContact ND2-O 3.14Å; N93-E469 PolarHBondContact O-N 3.33Å; W95-E469 PolarHBondContact NE1-OE1 2.84Å; E469-M481 HydrophobicContact CB-CE 3.71Å; E469-M481 HydrophobicContact CG-CE 4.16Å; E469-M481 WeakPolarHBondContact OE2-CE 2.96Å
470	C	72.4	Confident	69.8	Low	110 Å²	110	79.1 Å²	79.1	74%	0.743	39%	0.393	S	S	*	.			trans	-109.8	80.4	175	-173.4	0	0	0	0	110.5
471	V	71	Confident	71.4	Confident	27 Å²	27	74.6 Å²	74.6	16%	0.164	37%	0.372	C	S	.	.			trans	-80.6	127.1	171.5	-175	0	0	0	0	109.3	N93 Q475 K477 M481	N93-V471 PolarHBondContact ND2-N 3.04Å; V471-Q475 HydrophobicContact CG1-CB 3.83Å; V471-K477 HydrophobicContact CB-CG 4.21Å; V471-K477 HydrophobicContact CG1-CG 3.91Å; V471-M481 HydrophobicContact CG2-CE 4.04Å; V471-M481 HydrophobicContact CG2-SD 4.09Å
472	A	68.9	Low	72.8	Confident	25 Å²	25	71.7 Å²	71.7	21%	0.207	35%	0.351	C	S	.	.			trans	-69.4	143.6	-177.3	0	0	0	0	0	111.5	Y474 Q475	A472-Y474 HydrophobicContact CB-CD1 4Å; A472-Y474 HydrophobicContact CB-CE1 3.49Å; A472-Y474 VanDerWaalsContact CB-CE1 3.49Å; A472-Y474 HydrophobicContact CB-CE2 4.05Å; A472-Y474 HydrophobicContact CB-CG 4.47Å; A472-Y474 PolarHBondContact O-N 3.11Å; A472-Q475 HydrophobicContact CB-CG 4.49Å; A472-Q475 WeakPolarHBondContact O-CB 3.46Å; A472-Q475 PolarHBondContact O-N 3.07Å
473	R	64.7	Low	73.8	Confident	167 Å²	167	73.2 Å²	73.2	63%	0.63	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-21.2	-175.9	-74.1	-174.7	175.5	150	5.8	115.7	T89 E91	T89-R473 PolarHBondContact O-NH2 2.91Å; E91-R473 IonicContact OE1-CZ 3.36Å; E91-R473 IonicContact OE1-NE 2.87Å; E91-R473 PolarHBondContact OE1-NE 3.31Å; E91-R473 IonicContact OE1-NH2 2.96Å; E91-R473 PolarHBondContact OE1-NH2 3.27Å
474	Y	68.8	Low	74.5	Confident	203 Å²	203	71.2 Å²	71.2	80%	0.796	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-7.4	177.2	57.6	-101.4	0	0	0	113.8	A472	A472-Y474 HydrophobicContact CB-CD1 4Å; A472-Y474 HydrophobicContact CB-CE1 3.49Å; A472-Y474 VanDerWaalsContact CB-CE1 3.49Å; A472-Y474 HydrophobicContact CB-CE2 4.05Å; A472-Y474 HydrophobicContact CB-CG 4.47Å; A472-Y474 PolarHBondContact O-N 3.11Å
475	Q	68.2	Low	74.9	Confident	106 Å²	106	74.3 Å²	74.3	50%	0.495	37%	0.373	S	S	.	.	S	Bend	trans	-91.1	140.3	172.9	-67.3	175.2	-45.3	0	0	109.3	V471 A472 K477	V471-Q475 HydrophobicContact CG1-CB 3.83Å; A472-Q475 HydrophobicContact CB-CG 4.49Å; A472-Q475 WeakPolarHBondContact O-CB 3.46Å; A472-Q475 PolarHBondContact O-N 3.07Å; Q475-K477 PolarHBondContact O-N 3.09Å
476	T	62.2	Low	75.4	Confident	140 Å²	140	72.2 Å²	72.2	86%	0.859	37%	0.365	S	S	*	.			trans	-66.5	104.7	170.1	49.6	0	0	0	0	109
477	K	65.4	Low	75.8	Confident	55 Å²	55	73 Å²	73	24%	0.239	38%	0.379	C	S	.	.			trans	-58.2	143.3	173.3	-58.2	-172.1	-176.8	-172.1	0	109.6	E91 N93 V471 Q475 T483	E91-K477 IonicContact OE2-NZ 3.28Å; E91-K477 PolarHBondContact OE2-NZ 3.4Å; N93-K477 WeakPolarHBondContact OD1-CD 3.37Å; N93-K477 WeakPolarHBondContact OD1-CE 3.17Å; N93-K477 PolarHBondContact OD1-NZ 3.06Å; V471-K477 HydrophobicContact CB-CG 4.21Å; V471-K477 HydrophobicContact CG1-CG 3.91Å; Q475-K477 PolarHBondContact O-N 3.09Å; K477-T483 PolarHBondContact NZ-OG1 2.95Å
478	Q	61.1	Low	76.3	Confident	130 Å²	130	71 Å²	71	61%	0.607	37%	0.365	S	S	*	.			trans	-70.3	148.9	172.6	-69.2	-142	-7.6	0	0	110.3	W95 S480 M481	W95-Q478 HydrophobicContact CH2-CB 3.43Å; W95-Q478 VanDerWaalsContact CH2-CB 3.43Å; W95-Q478 HydrophobicContact CH2-CG 4.09Å; W95-Q478 HydrophobicContact CZ2-CB 4.33Å; W95-Q478 HydrophobicContact CZ3-CB 4.02Å; Q478-S480 VanDerWaalsContact C-N 3.34Å; Q478-S480 PolarHBondContact O-N 3.43Å; Q478-M481 HydrophobicContact CB-CG 4.23Å; Q478-M481 HydrophobicContact CB-SD 4.25Å; Q478-M481 WeakPolarHBondContact O-CB 3.18Å; Q478-M481 WeakPolarHBondContact O-CG 3.27Å; Q478-M481 PolarHBondContact O-N 3.21Å; Q478-M481 VanDerWaalsContact O-N 3.12Å
479	R	57.3	Low	76.9	Confident	106 Å²	106	71.9 Å²	71.9	40%	0.4	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.4	-150.6	-40.4	-166.6	82.8	-96.9	-8.4	113.7	D399 S400 P401	D399-R479 PolarHBondContact O-NH1 2.96Å; D399-R479 PolarHBondContact O-NH2 3.41Å; S400-R479 VanDerWaalsContact CA-CZ 3.43Å; S400-R479 VanDerWaalsContact OG-CD 3.28Å; S400-R479 WeakPolarHBondContact OG-CD 3.48Å; S400-R479 PolarHBondContact OG-NH1 3.15Å; S400-R479 VanDerWaalsContact OG-NH1 3.17Å; P401-R479 VanDerWaalsContact CD-NH2 3.31Å
480	S	68.6	Low	77.6	Confident	41 Å²	41	68.4 Å²	68.4	29%	0.287	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.6	170.6	19.9	0	0	0	0	113.8	W95 P96 Q478	W95-S480 WeakPolarHBondContact CZ3-OG 3.31Å; P96-S480 WeakPolarHBondContact CD-O 3.16Å; Q478-S480 VanDerWaalsContact C-N 3.34Å; Q478-S480 PolarHBondContact O-N 3.43Å
481	M	78.4	Confident	78.6	Confident	19 Å²	19	64 Å²	64	9%	0.094	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-82.8	133	-180	-59	-175.9	84.7	0	0	112.2	N93 W95 E469 V471 Q478	N93-M481 HydrophobicContact CB-CE 3.62Å; W95-M481 HydrophobicContact CD2-CE 4.41Å; W95-M481 HydrophobicContact CD2-CG 3.78Å; W95-M481 HydrophobicContact CE3-CG 3.63Å; W95-M481 HydrophobicContact CH2-CG 3.61Å; W95-M481 HydrophobicContact CH2-SD 4.07Å; W95-M481 HydrophobicContact CZ2-CE 4.03Å; W95-M481 HydrophobicContact CZ2-CG 3.7Å; W95-M481 HydrophobicContact CZ2-SD 3.75Å; W95-M481 HydrophobicContact CZ3-CG 3.55Å; E469-M481 HydrophobicContact CB-CE 3.71Å; E469-M481 HydrophobicContact CG-CE 4.16Å; E469-M481 WeakPolarHBondContact OE2-CE 2.96Å; V471-M481 HydrophobicContact CG2-CE 4.04Å; V471-M481 HydrophobicContact CG2-SD 4.09Å; Q478-M481 HydrophobicContact CB-CG 4.23Å; Q478-M481 HydrophobicContact CB-SD 4.25Å; Q478-M481 WeakPolarHBondContact O-CB 3.18Å; Q478-M481 WeakPolarHBondContact O-CG 3.27Å; Q478-M481 PolarHBondContact O-N 3.21Å; Q478-M481 VanDerWaalsContact O-N 3.12Å
482	F	83.8	Confident	79.7	Confident	39 Å²	39	69.1 Å²	69.1	17%	0.171	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.8	170.2	-61.5	-75.7	0	0	0	110.3	N93 R94 P96 L130 L393 L464 F484	N93-F482 CarbonylContact C-O 3.5Å; N93-F482 WeakPolarHBondContact CA-O 3.37Å; R94-F482 PolarHBondContact N-O 3.47Å; R94-F482 PolarHBondContact O-N 3.34Å; P96-F482 HydrophobicContact CB-CE2 4.33Å; P96-F482 HydrophobicContact CG-CE2 4.49Å; L130-F482 HydrophobicContact CD1-CD1 3.54Å; L130-F482 HydrophobicContact CD1-CE1 3.81Å; L130-F482 HydrophobicContact CD1-CG 4.25Å; L130-F482 HydrophobicContact CD2-CB 4.44Å; L130-F482 HydrophobicContact CD2-CD1 3.7Å; L130-F482 HydrophobicContact CD2-CD2 3.86Å; L130-F482 HydrophobicContact CD2-CE1 3.83Å; L130-F482 HydrophobicContact CD2-CE2 3.99Å; L130-F482 HydrophobicContact CD2-CG 3.71Å; L130-F482 HydrophobicContact CD2-CZ 3.97Å; L130-F482 HydrophobicContact CG-CD1 4.3Å; L130-F482 HydrophobicContact CG-CE1 4.46Å; L393-F482 HydrophobicContact CD2-CZ 4.38Å; L464-F482 HydrophobicContact CD2-CD2 3.63Å; L464-F482 HydrophobicContact CD2-CE2 4.19Å; L464-F482 HydrophobicContact CD2-CG 4.4Å; F482-F484 HydrophobicContact CB-CE2 3.66Å; F482-F484 HydrophobicContact CB-CZ 3.67Å
483	T	86.1	Confident	80.9	Confident	61 Å²	61	70.8 Å²	70.8	37%	0.374	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.3	174.9	-58.5	0	0	0	0	110.1	E91 N93 K477	E91-T483 HydrophobicContact CB-CG2 4.25Å; E91-T483 HydrophobicContact CG-CG2 3.84Å; E91-T483 WeakPolarHBondContact OE2-CG2 3.4Å; N93-T483 PolarHBondContact OD1-OG1 3.27Å; N93-T483 VanDerWaalsContact OD1-OG1 3.1Å; K477-T483 PolarHBondContact NZ-OG1 2.95Å
484	F	89.8	Confident	82.4	Confident	5 Å²	5	64 Å²	64	2%	0.022	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.6	174.7	-58.8	-79.4	0	0	0	109.8	E91 W92 R94 D126 M129 L130 L464 F482	E91-F484 WeakPolarHBondContact CA-O 3.36Å; W92-F484 HydrophobicContact CD2-CB 4.16Å; W92-F484 HydrophobicContact CG-CB 4.46Å; W92-F484 HydrophobicContact CZ2-CB 3.92Å; W92-F484 PolarHBondContact N-O 3.13Å; W92-F484 VanDerWaalsContact N-O 3.12Å; W92-F484 PolarHBondContact O-N 3.2Å; R94-F484 HydrophobicContact CB-CE2 4.14Å; R94-F484 HydrophobicContact CG-CD2 4.44Å; R94-F484 HydrophobicContact CG-CE2 4.2Å; D126-F484 HydrophobicContact CB-CD1 3.85Å; D126-F484 HydrophobicContact CB-CD2 4.04Å; D126-F484 HydrophobicContact CB-CE1 3.79Å; D126-F484 HydrophobicContact CB-CE2 3.98Å; D126-F484 HydrophobicContact CB-CG 3.99Å; D126-F484 HydrophobicContact CB-CZ 3.86Å; D126-F484 WeakPolarHBondContact O-CE1 3.46Å; M129-F484 HydrophobicContact CB-CD1 4.44Å; M129-F484 HydrophobicContact SD-CD1 3.88Å; L130-F484 HydrophobicContact CB-CE1 4.08Å; L130-F484 HydrophobicContact CB-CZ 4.3Å; L464-F484 HydrophobicContact CD1-CE1 4.37Å; L464-F484 HydrophobicContact CD1-CE2 3.94Å; L464-F484 HydrophobicContact CD1-CZ 3.48Å; L464-F484 VanDerWaalsContact CD1-CZ 3.48Å; F482-F484 HydrophobicContact CB-CE2 3.66Å; F482-F484 HydrophobicContact CB-CZ 3.67Å
485	V	90.4	Very high	83.7	Confident	65 Å²	65	57.2 Å²	57.2	39%	0.394	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.9	178.5	-176.3	0	0	0	0	108.4	M90 E91	M90-V485 CarbonylContact O-C 3.56Å; M90-V485 WeakPolarHBondContact O-CA 3.28Å; E91-V485 HydrophobicContact CG-CG2 3.91Å
486	C	92.9	Very high	85	Confident	21 Å²	21	56.1 Å²	56.1	14%	0.142	30%	0.297	C	S	.	.			trans	-57.4	-53.6	177.6	-177.4	0	0	0	0	112.3	C88 M90 W92 Q488	C88-C486 HydrophobicContact CB-CB 3.88Å; M90-C486 PolarHBondContact O-N 3.3Å; W92-C486 HydrophobicContact CH2-CB 4.32Å; W92-C486 HydrophobicContact CZ3-CB 3.93Å; C486-Q488 PolarHBondContact O-N 3.32Å
487	G	92.9	Very high	86.5	Confident	40 Å²	40	50.2 Å²	50.2	41%	0.412	26%	0.261	S	S	.	.			trans	66.3	-5.3	175.3	0	0	0	0	0	115.7	C88	C88-G487 PolarHBondContact O-N 3.07Å
488	Q	94.3	Very high	88	Confident	31 Å²	31	47.8 Å²	47.8	15%	0.145	25%	0.251	C	S	.	.			trans	-68.8	145.6	-178.7	-69.5	-177.4	-22.5	0	0	111.5	C88 C486 F490 G548 T649	C88-Q488 PolarHBondContact N-O 3.19Å; C486-Q488 PolarHBondContact O-N 3.32Å; Q488-F490 HydrophobicContact CB-CD2 4.46Å; Q488-F490 HydrophobicContact CB-CE1 4.48Å; Q488-F490 HydrophobicContact CB-CE2 3.45Å; Q488-F490 VanDerWaalsContact CB-CE2 3.45Å; Q488-F490 HydrophobicContact CB-CZ 3.46Å; Q488-F490 VanDerWaalsContact CB-CZ 3.46Å; Q488-F490 HydrophobicContact CG-CZ 4.44Å; Q488-G548 PolarHBondContact NE2-O 3.15Å; Q488-T649 VanDerWaalsContact CD-OG1 3.23Å; Q488-T649 PolarHBondContact NE2-OG1 2.73Å; Q488-T649 PolarHBondContact OE1-OG1 3.44Å
489	L	95.7	Very high	89.7	Confident	46 Å²	46	45.9 Å²	45.9	24%	0.241	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.5	-178.8	-62.3	-177.1	0	0	0	109.9	I85 C87 M621 V623	I85-L489 HydrophobicContact CG2-CB 3.88Å; I85-L489 HydrophobicContact CG2-CD2 4.1Å; I85-L489 HydrophobicContact CG2-CG 4.39Å; C87-L489 HydrophobicContact CB-CD2 3.63Å; L489-M621 HydrophobicContact CB-CE 4.07Å; L489-M621 HydrophobicContact CB-SD 4.38Å; L489-M621 WeakPolarHBondContact O-CE 3.45Å; L489-V623 HydrophobicContact CD1-CG1 3.84Å; L489-V623 HydrophobicContact CD1-CG2 3.89Å
490	F	96.1	Very high	91.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	155.6	-177.6	-60.4	-72.7	0	0	0	110.9	I85 V86 C88 Q488 E494 H498 A650	I85-F490 CarbonylContact C-O 3.51Å; I85-F490 VanDerWaalsContact CA-O 3.29Å; I85-F490 WeakPolarHBondContact CA-O 3.32Å; I85-F490 WeakPolarHBondContact CG2-O 3.3Å; V86-F490 PolarHBondContact N-O 2.78Å; V86-F490 PolarHBondContact O-N 2.68Å; C88-F490 HydrophobicContact CB-CD2 4.34Å; C88-F490 HydrophobicContact CB-CE2 3.99Å; Q488-F490 HydrophobicContact CB-CD2 4.46Å; Q488-F490 HydrophobicContact CB-CE1 4.48Å; Q488-F490 HydrophobicContact CB-CE2 3.45Å; Q488-F490 VanDerWaalsContact CB-CE2 3.45Å; Q488-F490 HydrophobicContact CB-CZ 3.46Å; Q488-F490 VanDerWaalsContact CB-CZ 3.46Å; Q488-F490 HydrophobicContact CG-CZ 4.44Å; F490-E494 HydrophobicContact CB-CB 4.29Å; F490-H498 HydrophobicContact CD1-CB 4.38Å; F490-H498 HydrophobicContact CD2-CB 4.48Å; F490-H498 AromaticContact CD2-CD2 3.86Å; F490-H498 HydrophobicContact CE1-CB 4.19Å; F490-H498 AromaticContact CE1-CG 3.95Å; F490-H498 AromaticContact CE1-ND1 3.87Å; F490-H498 HydrophobicContact CE2-CB 4.28Å; F490-H498 AromaticContact CE2-CD2 3.31Å; F490-H498 WeakPolarHBondContact CE2-CD2 3.33Å; F490-H498 AromaticContact CE2-CE1 3.53Å; F490-H498 AromaticContact CE2-CG 3.46Å; F490-H498 VanDerWaalsContact CE2-CG 3.46Å; F490-H498 AromaticContact CE2-ND1 3.6Å; F490-H498 AromaticContact CE2-NE2 3.37Å; F490-H498 WeakPolarHBondContact CE2-NE2 3.34Å; F490-H498 HydrophobicContact CZ-CB 4.13Å; F490-H498 AromaticContact CZ-CD2 3.75Å; F490-H498 AromaticContact CZ-CE1 3.39Å; F490-H498 WeakPolarHBondContact CZ-CE1 3.36Å; F490-H498 AromaticContact CZ-CG 3.4Å; F490-H498 VanDerWaalsContact CZ-CG 3.4Å; F490-H498 AromaticContact CZ-ND1 3.17Å; F490-H498 WeakPolarHBondContact CZ-ND1 3.41Å; F490-H498 AromaticContact CZ-NE2 3.75Å; F490-A650 HydrophobicContact CD1-CB 3.75Å; F490-A650 HydrophobicContact CE1-CB 3.78Å
491	R	95.1	Very high	92.7	Very high	18 Å²	18	42.7 Å²	42.7	7%	0.068	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	154.9	161.5	-60.1	162.8	45.9	131.7	-11.6	109.8	T80 D493 E494 F495 M618 R619 G620 M621	T80-R491 PolarHBondContact O-NH2 2.83Å; R491-D493 VanDerWaalsContact C-N 3.26Å; R491-D493 WeakPolarHBondContact CB-OD1 3.43Å; R491-D493 IonicContact CZ-OD1 3.93Å; R491-D493 IonicContact CZ-OD2 3.74Å; R491-D493 IonicContact NE-OD1 3.44Å; R491-D493 PolarHBondContact NE-OD1 3.38Å; R491-D493 IonicContact NE-OD2 3.48Å; R491-D493 IonicContact NH2-OD1 3.34Å; R491-D493 IonicContact NH2-OD2 2.74Å; R491-D493 PolarHBondContact NH2-OD2 3.31Å; R491-D493 PolarHBondContact O-N 2.9Å; R491-E494 HydrophobicContact CB-CG 4.11Å; R491-E494 WeakPolarHBondContact CB-OE2 3.1Å; R491-E494 PolarHBondContact N-OE2 2.58Å; R491-E494 PolarHBondContact O-N 3.03Å; R491-E494 VanDerWaalsContact O-N 3.11Å; R491-F495 PolarHBondContact O-N 2.64Å; R491-M618 PolarHBondContact NH1-O 2.81Å; R491-R619 WeakPolarHBondContact CD-O 3.44Å; R491-R619 PolarHBondContact NH1-O 3.47Å; R491-G620 PolarHBondContact NH1-O 3.43Å; R491-M621 HydrophobicContact CG-CB 3.78Å
492	R	94	Very high	93.5	Very high	133 Å²	133	42.1 Å²	42.1	50%	0.502	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.5	-179.4	-179.4	171.6	-65.5	-80.8	-8.6	113.8	S84 V86	S84-R492 PolarHBondContact O-N 2.88Å; S84-R492 PolarHBondContact OG-NE 3.3Å; V86-R492 HydrophobicContact CG2-CB 4.35Å
493	D	94	Very high	94	Very high	60 Å²	60	41.2 Å²	41.2	32%	0.321	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-35.7	176.3	47.4	-9.6	0	0	0	112.9	E79 T80 R491	E79-D493 WeakPolarHBondContact O-CB 3.46Å; E79-D493 PolarHBondContact O-N 3.33Å; T80-D493 WeakPolarHBondContact CG2-OD2 3.47Å; R491-D493 VanDerWaalsContact C-N 3.26Å; R491-D493 WeakPolarHBondContact CB-OD1 3.43Å; R491-D493 IonicContact CZ-OD1 3.93Å; R491-D493 IonicContact CZ-OD2 3.74Å; R491-D493 IonicContact NE-OD1 3.44Å; R491-D493 PolarHBondContact NE-OD1 3.38Å; R491-D493 IonicContact NE-OD2 3.48Å; R491-D493 IonicContact NH2-OD1 3.34Å; R491-D493 IonicContact NH2-OD2 2.74Å; R491-D493 PolarHBondContact NH2-OD2 3.31Å; R491-D493 PolarHBondContact O-N 2.9Å
494	E	95.6	Very high	94.3	Very high	24 Å²	24	40 Å²	40	11%	0.112	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-23.8	-179.9	-60.4	174.7	135.5	0	0	114	F490 R491 S496 S497 H498 S595 S648 A650	F490-E494 HydrophobicContact CB-CB 4.29Å; R491-E494 HydrophobicContact CB-CG 4.11Å; R491-E494 WeakPolarHBondContact CB-OE2 3.1Å; R491-E494 PolarHBondContact N-OE2 2.58Å; R491-E494 PolarHBondContact O-N 3.03Å; R491-E494 VanDerWaalsContact O-N 3.11Å; E494-S496 VanDerWaalsContact C-N 3.28Å; E494-S496 PolarHBondContact O-N 2.86Å; E494-S497 PolarHBondContact O-N 3.05Å; E494-S497 PolarHBondContact O-OG 3.32Å; E494-H498 PolarHBondContact O-N 3.06Å; E494-S595 WeakPolarHBondContact OE1-CB 3.42Å; E494-S595 PolarHBondContact OE1-OG 2.79Å; E494-S648 PolarHBondContact OE1-OG 3.29Å; E494-S648 WeakPolarHBondContact OE2-CB 3.35Å; E494-S648 PolarHBondContact OE2-OG 3.2Å; E494-A650 HydrophobicContact CB-CB 4.15Å
495	F	95.4	Very high	94.5	Very high	62 Å²	62	41.8 Å²	41.8	27%	0.272	23%	0.228	S	C	.	.	H	α-helix	trans	-58.6	-37.9	-173.2	177.4	-101.6	0	0	0	113.4	V86 C88 R491 F499	V86-F495 HydrophobicContact CB-CB 4.42Å; V86-F495 HydrophobicContact CB-CD2 4.37Å; V86-F495 HydrophobicContact CB-CG 4.43Å; V86-F495 HydrophobicContact CG1-CB 4.48Å; V86-F495 HydrophobicContact CG1-CD2 3.74Å; V86-F495 HydrophobicContact CG1-CE2 4.11Å; V86-F495 HydrophobicContact CG1-CG 3.96Å; C88-F495 HydrophobicContact CB-CE2 4.14Å; R491-F495 PolarHBondContact O-N 2.64Å; F495-F499 HydrophobicContact CZ-CD2 4.42Å; F495-F499 WeakPolarHBondContact O-CB 3.48Å; F495-F499 PolarHBondContact O-N 3.1Å
496	S	95.2	Very high	94.6	Very high	83 Å²	83	38.7 Å²	38.7	58%	0.58	21%	0.209	S	C	*	.	H	α-helix	trans	-68.7	-38.5	-177.2	66.5	0	0	0	0	113.3	E494 K500	E494-S496 VanDerWaalsContact C-N 3.28Å; E494-S496 PolarHBondContact O-N 2.86Å; S496-K500 PolarHBondContact O-N 2.92Å
497	S	95.2	Very high	94.6	Very high	15 Å²	15	38.7 Å²	38.7	11%	0.105	21%	0.207	C	C	.	.	H	α-helix	trans	-74.5	-40.9	176	56.4	0	0	0	0	111.1	E494 F499 K500 N501 T653	E494-S497 PolarHBondContact O-N 3.05Å; E494-S497 PolarHBondContact O-OG 3.32Å; S497-F499 PolarHBondContact O-N 3.49Å; S497-K500 PolarHBondContact O-N 2.84Å; S497-N501 WeakPolarHBondContact O-CB 3.07Å; S497-N501 PolarHBondContact O-N 3.23Å; S497-N501 PolarHBondContact O-OD1 3.47Å; S497-T653 WeakPolarHBondContact CB-OG1 3.13Å
498	H	96.4	Very high	94.4	Very high	5 Å²	5	39.4 Å²	39.4	2%	0.023	21%	0.209	C	C	.	.	H	α-helix	trans	-54.9	-51.6	171.6	164.2	73.1	0	0	0	111.6	C88 F490 E494 K500 N501 V502 H503	C88-H498 PolarHBondContact SG-NE2 3.12Å; F490-H498 HydrophobicContact CD1-CB 4.38Å; F490-H498 HydrophobicContact CD2-CB 4.48Å; F490-H498 AromaticContact CD2-CD2 3.86Å; F490-H498 HydrophobicContact CE1-CB 4.19Å; F490-H498 AromaticContact CE1-CG 3.95Å; F490-H498 AromaticContact CE1-ND1 3.87Å; F490-H498 HydrophobicContact CE2-CB 4.28Å; F490-H498 AromaticContact CE2-CD2 3.31Å; F490-H498 WeakPolarHBondContact CE2-CD2 3.33Å; F490-H498 AromaticContact CE2-CE1 3.53Å; F490-H498 AromaticContact CE2-CG 3.46Å; F490-H498 VanDerWaalsContact CE2-CG 3.46Å; F490-H498 AromaticContact CE2-ND1 3.6Å; F490-H498 AromaticContact CE2-NE2 3.37Å; F490-H498 WeakPolarHBondContact CE2-NE2 3.34Å; F490-H498 HydrophobicContact CZ-CB 4.13Å; F490-H498 AromaticContact CZ-CD2 3.75Å; F490-H498 AromaticContact CZ-CE1 3.39Å; F490-H498 WeakPolarHBondContact CZ-CE1 3.36Å; F490-H498 AromaticContact CZ-CG 3.4Å; F490-H498 VanDerWaalsContact CZ-CG 3.4Å; F490-H498 AromaticContact CZ-ND1 3.17Å; F490-H498 WeakPolarHBondContact CZ-ND1 3.41Å; F490-H498 AromaticContact CZ-NE2 3.75Å; E494-H498 PolarHBondContact O-N 3.06Å; H498-K500 PolarHBondContact O-N 3Å; H498-N501 PolarHBondContact O-N 3.24Å; H498-V502 WeakPolarHBondContact O-CB 3.25Å; H498-V502 PolarHBondContact O-N 3.26Å; H498-H503 AromaticContact CE1-NE2 3.9Å; H498-H503 AromaticContact NE2-CD2 3.79Å; H498-H503 AromaticContact NE2-NE2 3.42Å; H498-H503 PolarHBondContact NE2-NE2 3.12Å
499	F	95.7	Very high	94.1	Very high	90 Å²	90	38.3 Å²	38.3	40%	0.395	21%	0.206	S	C	.	.	I	π-helix	trans	-58.3	-48.1	-179.9	-179.8	-83	0	0	0	111.6	M90 F495 S497 H503 G504	M90-F499 HydrophobicContact CG-CD2 3.9Å; M90-F499 HydrophobicContact CG-CE2 3.66Å; M90-F499 HydrophobicContact SD-CD2 4.47Å; M90-F499 HydrophobicContact SD-CE2 3.65Å; M90-F499 HydrophobicContact SD-CZ 4.49Å; F495-F499 HydrophobicContact CZ-CD2 4.42Å; F495-F499 WeakPolarHBondContact O-CB 3.48Å; F495-F499 PolarHBondContact O-N 3.1Å; S497-F499 PolarHBondContact O-N 3.49Å; F499-H503 WeakPolarHBondContact O-CA 3.27Å; F499-H503 WeakPolarHBondContact O-CB 3.49Å; F499-H503 PolarHBondContact O-N 3.02Å; F499-G504 PolarHBondContact O-N 3.38Å
500	K	95.6	Very high	93.7	Very high	80 Å²	80	36.3 Å²	36.3	35%	0.348	20%	0.196	S	C	.	.	I	π-helix	trans	-61.2	-60.4	178	-174.7	-158.6	171.6	-167.8	0	110.7	S496 S497 H498 V502 G504 D505 V654	S496-K500 PolarHBondContact O-N 2.92Å; S497-K500 PolarHBondContact O-N 2.84Å; H498-K500 PolarHBondContact O-N 3Å; K500-V502 PolarHBondContact O-N 3.25Å; K500-G504 CarbonylContact O-C 3.54Å; K500-G504 VanDerWaalsContact O-CA 3.26Å; K500-G504 WeakPolarHBondContact O-CA 3.27Å; K500-G504 PolarHBondContact O-N 3.42Å; K500-G504 VanDerWaalsContact O-N 3.11Å; K500-D505 WeakPolarHBondContact CE-OD2 3.42Å; K500-D505 PolarHBondContact O-N 2.96Å; K500-V654 PolarHBondContact NZ-O 3.46Å
501	N	95.2	Very high	93	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	I	π-helix	trans	-58.9	-50.2	-173.7	-71.2	1.6	0	0	0	111.8	S497 H498 I506 F651 G652 V654	S497-N501 WeakPolarHBondContact O-CB 3.07Å; S497-N501 PolarHBondContact O-N 3.23Å; S497-N501 PolarHBondContact O-OD1 3.47Å; H498-N501 PolarHBondContact O-N 3.24Å; N501-I506 WeakPolarHBondContact O-CB 3.35Å; N501-I506 WeakPolarHBondContact O-CD1 3.4Å; N501-I506 VanDerWaalsContact O-CG1 3.23Å; N501-I506 WeakPolarHBondContact O-CG1 3.37Å; N501-I506 PolarHBondContact O-N 2.8Å; N501-F651 HydrophobicContact CB-CE1 4.13Å; N501-F651 HydrophobicContact CB-CE2 4.11Å; N501-F651 HydrophobicContact CB-CZ 3.6Å; N501-F651 WeakPolarHBondContact ND2-CE2 3.28Å; N501-G652 PolarHBondContact ND2-O 3.44Å; N501-V654 PolarHBondContact OD1-N 3.3Å
502	V	94.8	Very high	92.4	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.036	23%	0.232	C	C	.	.	I	π-helix	trans	-85.3	-54.6	-171.2	-180	0	0	0	0	111.2	H498 K500 H507 F550 F651	H498-V502 WeakPolarHBondContact O-CB 3.25Å; H498-V502 PolarHBondContact O-N 3.26Å; K500-V502 PolarHBondContact O-N 3.25Å; V502-H507 WeakPolarHBondContact CG1-NE2 3.41Å; V502-H507 WeakPolarHBondContact O-CB 3.44Å; V502-H507 PolarHBondContact O-CD2 2.97Å; V502-H507 PolarHBondContact O-N 3.1Å; V502-F550 HydrophobicContact CG1-CD2 3.94Å; V502-F550 HydrophobicContact CG1-CE2 4.22Å; V502-F550 HydrophobicContact CG2-CD2 4.45Å; V502-F651 HydrophobicContact CG2-CE1 4.01Å
503	H	93.8	Very high	91.9	Very high	21 Å²	21	42.5 Å²	42.5	10%	0.097	24%	0.237	C	C	.	.	I	π-helix	trans	-90.4	-35.5	-172.2	-61	-47.5	0	0	0	113.6	C88 M90 W92 H498 F499 H507	C88-H503 PolarHBondContact SG-NE2 2.82Å; C88-H503 VanDerWaalsContact SG-NE2 3.38Å; M90-H503 HydrophobicContact CG-CB 4.41Å; W92-H503 AromaticContact CZ3-CE1 3.8Å; H498-H503 AromaticContact CE1-NE2 3.9Å; H498-H503 AromaticContact NE2-CD2 3.79Å; H498-H503 AromaticContact NE2-NE2 3.42Å; H498-H503 PolarHBondContact NE2-NE2 3.12Å; F499-H503 WeakPolarHBondContact O-CA 3.27Å; F499-H503 WeakPolarHBondContact O-CB 3.49Å; F499-H503 PolarHBondContact O-N 3.02Å; H503-H507 AromaticContact CE1-CE1 3.66Å; H503-H507 AromaticContact ND1-CE1 3.42Å; H503-H507 PolarHBondContact ND1-CE1 2.71Å; H503-H507 AromaticContact ND1-CG 3.83Å; H503-H507 AromaticContact ND1-ND1 3.38Å; H503-H507 PolarHBondContact ND1-ND1 3.33Å; H503-H507 AromaticContact ND1-NE2 3.83Å
504	G	92.3	Very high	91.7	Very high	36 Å²	36	40 Å²	40	37%	0.371	22%	0.223	S	C	.	.	I	π-helix	trans	-74.7	-46.6	177	0	0	0	0	0	113.4	F499 K500 A508	F499-G504 PolarHBondContact O-N 3.38Å; K500-G504 CarbonylContact O-C 3.54Å; K500-G504 VanDerWaalsContact O-CA 3.26Å; K500-G504 WeakPolarHBondContact O-CA 3.27Å; K500-G504 PolarHBondContact O-N 3.42Å; K500-G504 VanDerWaalsContact O-N 3.11Å; G504-A508 WeakPolarHBondContact O-CB 3.3Å
505	D	93.4	Very high	91.4	Very high	42 Å²	42	38.9 Å²	38.9	23%	0.225	22%	0.218	C	C	.	.	I	π-helix	trans	-102.2	-57.3	-170	-59.7	-16.9	0	0	0	112.3	K500 G509 W657	K500-D505 WeakPolarHBondContact CE-OD2 3.42Å; K500-D505 PolarHBondContact O-N 2.96Å; D505-G509 PolarHBondContact O-N 3.18Å; D505-G509 VanDerWaalsContact O-N 3.09Å; D505-W657 HydrophobicContact CB-CZ2 3.75Å; D505-W657 VanDerWaalsContact CG-NE1 3.33Å; D505-W657 PolarHBondContact OD2-NE1 3.45Å
506	I	93.2	Very high	91.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-68.8	-60.6	-176.4	-67.4	164.2	0	0	0	111.5	N501 A508 G509 L510 M514 I541 F550 F651 W657	N501-I506 WeakPolarHBondContact O-CB 3.35Å; N501-I506 WeakPolarHBondContact O-CD1 3.4Å; N501-I506 VanDerWaalsContact O-CG1 3.23Å; N501-I506 WeakPolarHBondContact O-CG1 3.37Å; N501-I506 PolarHBondContact O-N 2.8Å; I506-A508 VanDerWaalsContact C-N 3.26Å; I506-A508 PolarHBondContact O-N 3.28Å; I506-G509 CarbonylContact O-C 3.48Å; I506-G509 WeakPolarHBondContact O-CA 3.33Å; I506-G509 PolarHBondContact O-N 3.13Å; I506-L510 HydrophobicContact CG2-CD1 4.07Å; I506-L510 HydrophobicContact CG2-CD2 4.49Å; I506-L510 HydrophobicContact CG2-CG 4.12Å; I506-L510 WeakPolarHBondContact O-CG 3.4Å; I506-L510 PolarHBondContact O-N 3.48Å; I506-M514 HydrophobicContact CB-CE 4.49Å; I506-M514 HydrophobicContact CB-SD 4.45Å; I506-M514 HydrophobicContact CG1-CE 4.01Å; I506-M514 HydrophobicContact CG1-SD 4.03Å; I506-M514 HydrophobicContact CG2-SD 4.42Å; I506-I541 HydrophobicContact CD1-CD1 4.46Å; I506-I541 HydrophobicContact CD1-CG2 3.93Å; I506-F550 HydrophobicContact CD1-CB 3.96Å; I506-F550 HydrophobicContact CD1-CD1 4.39Å; I506-F550 HydrophobicContact CD1-CD2 4.39Å; I506-F550 HydrophobicContact CD1-CG 3.99Å; I506-F550 HydrophobicContact CG2-CD1 4.21Å; I506-F550 HydrophobicContact CG2-CD2 4.28Å; I506-F550 HydrophobicContact CG2-CE1 3.92Å; I506-F550 HydrophobicContact CG2-CE2 4Å; I506-F550 HydrophobicContact CG2-CG 4.38Å; I506-F550 HydrophobicContact CG2-CZ 3.81Å; I506-F651 HydrophobicContact CD1-CE1 4.29Å; I506-F651 HydrophobicContact CD1-CZ 3.89Å; I506-W657 HydrophobicContact CG1-CH2 4.05Å; I506-W657 HydrophobicContact CG1-CZ2 4.33Å
507	H	92.6	Very high	90.7	Very high	21 Å²	21	36.5 Å²	36.5	10%	0.097	20%	0.197	C	C	.	.	H	α-helix	trans	-56.8	-39.8	-176.3	-78	-144.3	0	0	0	112	W92 L468 V502 H503 G509 F550	W92-H507 AromaticContact CD2-CE1 3.82Å; W92-H507 AromaticContact CE3-CE1 3.62Å; W92-H507 AromaticContact CE3-ND1 3.88Å; W92-H507 AromaticContact CH2-CE1 3.97Å; W92-H507 AromaticContact CZ3-CE1 3.71Å; L468-H507 HydrophobicContact CD2-CB 3.91Å; V502-H507 WeakPolarHBondContact CG1-NE2 3.41Å; V502-H507 WeakPolarHBondContact O-CB 3.44Å; V502-H507 PolarHBondContact O-CD2 2.97Å; V502-H507 PolarHBondContact O-N 3.1Å; H503-H507 AromaticContact CE1-CE1 3.66Å; H503-H507 AromaticContact ND1-CE1 3.42Å; H503-H507 PolarHBondContact ND1-CE1 2.71Å; H503-H507 AromaticContact ND1-CG 3.83Å; H503-H507 AromaticContact ND1-ND1 3.38Å; H503-H507 PolarHBondContact ND1-ND1 3.33Å; H503-H507 AromaticContact ND1-NE2 3.83Å; H507-G509 VanDerWaalsContact C-N 3.32Å; H507-F550 AromaticContact NE2-CE2 3.82Å
508	A	88.3	Confident	90.5	Very high	54 Å²	54	35.9 Å²	35.9	45%	0.446	19%	0.193	S	C	.	.	H	α-helix	trans	-70.6	-25.7	176.2	0	0	0	0	0	113.4	G504 I506 N511	G504-A508 WeakPolarHBondContact O-CB 3.3Å; I506-A508 VanDerWaalsContact C-N 3.26Å; I506-A508 PolarHBondContact O-N 3.28Å; A508-N511 PolarHBondContact O-ND2 3.23Å; A508-N511 PolarHBondContact O-OD1 2.92Å
509	G	88.6	Confident	90.1	Very high	9 Å²	9	39.5 Å²	39.5	9%	0.093	22%	0.216	C	C	.	.	H	α-helix	trans	-89.5	-15.2	177.8	0	0	0	0	0	115.3	D505 I506 H507 N511 W513 M514	D505-G509 PolarHBondContact O-N 3.18Å; D505-G509 VanDerWaalsContact O-N 3.09Å; I506-G509 CarbonylContact O-C 3.48Å; I506-G509 WeakPolarHBondContact O-CA 3.33Å; I506-G509 PolarHBondContact O-N 3.13Å; H507-G509 VanDerWaalsContact C-N 3.32Å; G509-N511 PolarHBondContact O-N 2.89Å; G509-N511 VanDerWaalsContact O-N 3.14Å; G509-N511 PolarHBondContact O-OD1 2.82Å; G509-W513 PolarHBondContact O-N 3.28Å; G509-W513 VanDerWaalsContact O-N 3.14Å; G509-M514 WeakPolarHBondContact O-CB 3.24Å; G509-M514 PolarHBondContact O-N 3.2Å
510	L	88.2	Confident	89.8	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-1.2	178.2	-70.4	179.3	0	0	0	114	L118 D119 L122 L468 I506 G512 E515 F550	L118-L510 HydrophobicContact CB-CD2 3.64Å; D119-L510 HydrophobicContact CB-CB 4.49Å; D119-L510 HydrophobicContact CB-CD2 4.24Å; L122-L510 HydrophobicContact CD2-CD1 3.87Å; L468-L510 HydrophobicContact CD1-CB 4.04Å; L468-L510 HydrophobicContact CD1-CD1 4.27Å; I506-L510 HydrophobicContact CG2-CD1 4.07Å; I506-L510 HydrophobicContact CG2-CD2 4.49Å; I506-L510 HydrophobicContact CG2-CG 4.12Å; I506-L510 WeakPolarHBondContact O-CG 3.4Å; I506-L510 PolarHBondContact O-N 3.48Å; L510-G512 PolarHBondContact O-N 3.13Å; L510-G512 VanDerWaalsContact O-N 3.1Å; L510-E515 HydrophobicContact CD2-CB 4.38Å; L510-F550 HydrophobicContact CD1-CZ 4.23Å
511	N	80.9	Confident	89.3	Confident	86 Å²	86	33.1 Å²	33.1	46%	0.46	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	33.9	170.1	62.7	2.1	0	0	0	113.7	A508 G509	A508-N511 PolarHBondContact O-ND2 3.23Å; A508-N511 PolarHBondContact O-OD1 2.92Å; G509-N511 PolarHBondContact O-N 2.89Å; G509-N511 VanDerWaalsContact O-N 3.14Å; G509-N511 PolarHBondContact O-OD1 2.82Å
512	G	81	Confident	88.6	Confident	36 Å²	36	39.5 Å²	39.5	37%	0.371	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-2	-179.6	0	0	0	0	0	116	L510 E515	L510-G512 PolarHBondContact O-N 3.13Å; L510-G512 VanDerWaalsContact O-N 3.1Å; G512-E515 WeakPolarHBondContact CA-O 3.39Å
513	W	85.3	Confident	88	Confident	158 Å²	158	45.7 Å²	45.7	60%	0.598	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-47.8	176.7	-83.5	74.9	0	0	0	112.6	G509 R531 F532	G509-W513 PolarHBondContact O-N 3.28Å; G509-W513 VanDerWaalsContact O-N 3.14Å; W513-R531 WeakPolarHBondContact O-CD 3.27Å; W513-R531 PolarHBondContact O-NH1 3.43Å; W513-F532 HydrophobicContact CB-CE2 4.49Å; W513-F532 WeakPolarHBondContact O-CE2 3.41Å
514	M	89.6	Confident	87.3	Confident	8 Å²	8	45.1 Å²	45.1	4%	0.039	24%	0.24	C	C	.	.	S	Bend	trans	-87.9	-51.1	-177.5	-174.1	177.7	-69	0	0	112.2	L118 I506 G509 R530 R531 F532 W657	L118-M514 HydrophobicContact CD1-SD 4.36Å; I506-M514 HydrophobicContact CB-CE 4.49Å; I506-M514 HydrophobicContact CB-SD 4.45Å; I506-M514 HydrophobicContact CG1-CE 4.01Å; I506-M514 HydrophobicContact CG1-SD 4.03Å; I506-M514 HydrophobicContact CG2-SD 4.42Å; G509-M514 WeakPolarHBondContact O-CB 3.24Å; G509-M514 PolarHBondContact O-N 3.2Å; M514-R530 CarbonylContact O-C 3.43Å; M514-R530 WeakPolarHBondContact O-CA 3.39Å; M514-R531 PolarHBondContact O-N 3.31Å; M514-F532 HydrophobicContact CB-CD2 4.19Å; M514-F532 HydrophobicContact CG-CD2 4.35Å; M514-W657 HydrophobicContact CE-CE3 4.25Å; M514-W657 HydrophobicContact CE-CH2 3.6Å; M514-W657 HydrophobicContact CE-CZ2 4.04Å; M514-W657 HydrophobicContact CE-CZ3 3.72Å; M514-W657 HydrophobicContact SD-CH2 4.37Å; M514-W657 HydrophobicContact SD-CZ3 4.39Å
515	E	88.8	Confident	87	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	102.3	172.1	-171.7	70.6	-112.6	0	0	107.9	L118 L510 G512 S528 R530	L118-E515 PolarHBondContact N-OE2 3.41Å; L510-E515 HydrophobicContact CD2-CB 4.38Å; G512-E515 WeakPolarHBondContact CA-O 3.39Å; E515-S528 VanDerWaalsContact OE1-CB 3.25Å; E515-S528 WeakPolarHBondContact OE1-CB 3.44Å; E515-S528 PolarHBondContact OE1-OG 3.05Å; E515-R530 VanDerWaalsContact OE2-CG 3.29Å; E515-R530 WeakPolarHBondContact OE2-CG 3.41Å; E515-R530 IonicContact OE2-NE 2.69Å; E515-R530 PolarHBondContact OE2-NE 3.19Å
516	Q	89	Confident	86.6	Confident	54 Å²	54	43.5 Å²	43.5	25%	0.252	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	109.2	-178.7	-175	-174.4	27	0	0	110.3	S528 Q529 R531 M665	Q516-S528 CarbonylContact O-C 3.55Å; Q516-S528 VanDerWaalsContact O-CA 3.24Å; Q516-S528 WeakPolarHBondContact O-CA 3.27Å; Q516-Q529 HydrophobicContact CB-CG 4.19Å; Q516-Q529 PolarHBondContact N-O 2.79Å; Q516-Q529 PolarHBondContact O-N 3.15Å; Q516-R531 HydrophobicContact CB-CG 3.86Å; Q516-M665 HydrophobicContact CG-CE 4.06Å; Q516-M665 WeakPolarHBondContact O-CE 3.45Å
517	R	87.8	Confident	86.3	Confident	40 Å²	40	47.4 Å²	47.4	15%	0.151	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	154.8	172	-66	-176.7	172.9	-77.9	-9.5	111.9	Q117 D119 A521	Q117-R517 VanDerWaalsContact OE1-CZ 3.23Å; D119-R517 VanDerWaalsContact CG-NH2 3.31Å; D119-R517 IonicContact OD1-CZ 3.38Å; D119-R517 IonicContact OD1-NE 2.75Å; D119-R517 IonicContact OD1-NH2 3.19Å; D119-R517 PolarHBondContact OD1-NH2 3.39Å; D119-R517 IonicContact OD2-CZ 3.5Å; D119-R517 IonicContact OD2-NE 3.37Å; D119-R517 PolarHBondContact OD2-NE 3.36Å; D119-R517 IonicContact OD2-NH2 3.6Å; D119-R517 PolarHBondContact OD2-NH2 3.41Å; R517-A521 HydrophobicContact CB-CB 4.35Å
518	C	89.2	Confident	86.1	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.02	24%	0.243	C	C	.	.			trans	-55.3	133.6	166.6	-177.9	0	0	0	0	110.1	L520 A521 C525 Y527 M665 H668	C518-L520 PolarHBondContact O-N 3.44Å; C518-A521 VanDerWaalsContact O-CB 3.23Å; C518-A521 WeakPolarHBondContact O-CB 3.36Å; C518-A521 PolarHBondContact O-N 3.25Å; C518-C525 HydrophobicContact CB-CB 4.13Å; C518-Y527 PolarHBondContact N-O 3.48Å; C518-M665 HydrophobicContact CB-SD 4.26Å; C518-H668 VanDerWaalsContact SG-CD2 3.59Å; C518-H668 PolarHBondContact SG-NE2 3.03Å
519	P	89.8	Confident	86.1	Confident	80 Å²	80	45.8 Å²	45.8	52%	0.519	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-20.6	175.6	-28.1	35.5	0	0	0	114.3	Y522	P519-Y522 VanDerWaalsContact O-CD1 3.25Å; P519-Y522 WeakPolarHBondContact O-CD1 3.29Å; P519-Y522 WeakPolarHBondContact O-CE1 3.38Å
520	L	89.3	Confident	86.1	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.12	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	16.1	179.9	-56.2	168.4	0	0	0	112.6	C518 Y522 Y523 C525 L669 F674 N675	C518-L520 PolarHBondContact O-N 3.44Å; L520-Y522 PolarHBondContact O-N 3.39Å; L520-Y523 HydrophobicContact CB-CD2 4.22Å; L520-Y523 HydrophobicContact CD2-CD2 3.79Å; L520-Y523 HydrophobicContact CD2-CE2 3.85Å; L520-Y523 PolarHBondContact O-N 2.91Å; L520-C525 HydrophobicContact CB-CB 4.48Å; L520-C525 WeakPolarHBondContact O-CB 3.23Å; L520-C525 PolarHBondContact O-N 3.36Å; L520-L669 HydrophobicContact CD1-CD2 3.89Å; L520-L669 HydrophobicContact CG-CD2 4.43Å; L520-F674 HydrophobicContact CB-CB 4.14Å; L520-F674 HydrophobicContact CD1-CB 4.41Å; L520-N675 VanDerWaalsContact CD1-CA 3.47Å; L520-N675 HydrophobicContact CD1-CB 3.49Å; L520-N675 VanDerWaalsContact CD1-CB 3.49Å
521	A	84.1	Confident	86.2	Confident	13 Å²	13	50.3 Å²	50.3	11%	0.107	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-58.5	-32.8	178.2	0	0	0	0	0	112.9	R517 C518 Y523 G524 C525	R517-A521 HydrophobicContact CB-CB 4.35Å; C518-A521 VanDerWaalsContact O-CB 3.23Å; C518-A521 WeakPolarHBondContact O-CB 3.36Å; C518-A521 PolarHBondContact O-N 3.25Å; A521-Y523 PolarHBondContact O-N 3.08Å; A521-G524 WeakPolarHBondContact O-CA 3.46Å; A521-G524 PolarHBondContact O-N 3.43Å; A521-C525 WeakPolarHBondContact CA-O 3.47Å; A521-C525 WeakPolarHBondContact CB-O 3.23Å
522	Y	79.8	Confident	86.6	Confident	134 Å²	134	48 Å²	48	53%	0.525	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-64.7	-21.9	175.7	70.1	-88.5	0	0	0	113.8	P519 L520 G524	P519-Y522 VanDerWaalsContact O-CD1 3.25Å; P519-Y522 WeakPolarHBondContact O-CD1 3.29Å; P519-Y522 WeakPolarHBondContact O-CE1 3.38Å; L520-Y522 PolarHBondContact O-N 3.39Å; Y522-G524 VanDerWaalsContact C-N 3.33Å
523	Y	82.6	Confident	87.1	Confident	137 Å²	137	46.4 Å²	46.4	54%	0.537	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-83.7	-5.6	169.5	-66.8	-56	0	0	0	113.5	L520 A521 F674	L520-Y523 HydrophobicContact CB-CD2 4.22Å; L520-Y523 HydrophobicContact CD2-CD2 3.79Å; L520-Y523 HydrophobicContact CD2-CE2 3.85Å; L520-Y523 PolarHBondContact O-N 2.91Å; A521-Y523 PolarHBondContact O-N 3.08Å; Y523-F674 WeakPolarHBondContact O-CD1 3.47Å; Y523-F674 WeakPolarHBondContact O-CE1 3.42Å
524	G	80.4	Confident	87.4	Confident	8 Å²	8	39.1 Å²	39.1	8%	0.082	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.7	11.4	-178.2	0	0	0	0	0	115.3	A521 Y522 T526 F674	A521-G524 WeakPolarHBondContact O-CA 3.46Å; A521-G524 PolarHBondContact O-N 3.43Å; Y522-G524 VanDerWaalsContact C-N 3.33Å; G524-T526 PolarHBondContact O-N 3.39Å; G524-F674 VanDerWaalsContact C-CZ 3.47Å; G524-F674 WeakPolarHBondContact O-CE2 3.43Å; G524-F674 WeakPolarHBondContact O-CZ 3.37Å
525	C	84.9	Confident	87.1	Confident	8 Å²	8	40.7 Å²	40.7	5%	0.054	19%	0.194	C	C	.	.			trans	-75.7	110.3	175.9	-166.8	0	0	0	0	112	C518 L520 A521 Y527 H668 F674	C518-C525 HydrophobicContact CB-CB 4.13Å; L520-C525 HydrophobicContact CB-CB 4.48Å; L520-C525 WeakPolarHBondContact O-CB 3.23Å; L520-C525 PolarHBondContact O-N 3.36Å; A521-C525 WeakPolarHBondContact CA-O 3.47Å; A521-C525 WeakPolarHBondContact CB-O 3.23Å; C525-Y527 VanDerWaalsContact C-N 3.28Å; C525-Y527 PolarHBondContact O-N 3.25Å; C525-H668 PolarHBondContact SG-NE2 3.41Å; C525-H668 VanDerWaalsContact SG-NE2 3.38Å; C525-F674 HydrophobicContact CB-CD2 3.54Å; C525-F674 HydrophobicContact CB-CE2 3.99Å; C525-F674 HydrophobicContact CB-CG 4.29Å
526	T	84.6	Confident	86.9	Confident	37 Å²	37	44.1 Å²	44.1	23%	0.227	22%	0.215	C	C	.	.			trans	-76.7	-6.4	-178.5	59.1	0	0	0	0	114.9	L108 D111 Q117 G524 S528	L108-T526 HydrophobicContact CD2-CG2 4.14Å; D111-T526 WeakPolarHBondContact OD2-CG2 3.48Å; Q117-T526 PolarHBondContact NE2-O 3.2Å; G524-T526 PolarHBondContact O-N 3.39Å; T526-S528 PolarHBondContact O-N 3.42Å
527	Y	87.3	Confident	86.7	Confident	81 Å²	81	46 Å²	46	32%	0.318	22%	0.224	S	C	.	.			trans	-66.8	130.9	-176	-175.6	-98.1	0	0	0	113.4	C518 C525 M665 H668	C518-Y527 PolarHBondContact N-O 3.48Å; C525-Y527 VanDerWaalsContact C-N 3.28Å; C525-Y527 PolarHBondContact O-N 3.25Å; Y527-M665 HydrophobicContact CD1-CE 3.93Å; Y527-M665 HydrophobicContact CD1-SD 3.94Å; Y527-M665 HydrophobicContact CE1-CE 3.83Å; Y527-M665 HydrophobicContact CE1-SD 3.91Å; Y527-H668 WeakPolarHBondContact CB-CE1 3.36Å; Y527-H668 HydrophobicContact CD1-CB 3.84Å; Y527-H668 AromaticContact CD1-CD2 3.57Å; Y527-H668 AromaticContact CD1-CE1 3.77Å; Y527-H668 AromaticContact CD1-CG 3.28Å; Y527-H668 AromaticContact CD1-ND1 3.42Å; Y527-H668 WeakPolarHBondContact CD1-ND1 3.36Å; Y527-H668 AromaticContact CD1-NE2 3.89Å; Y527-H668 AromaticContact CD2-ND1 3.62Å; Y527-H668 HydrophobicContact CE1-CB 3.47Å; Y527-H668 VanDerWaalsContact CE1-CB 3.47Å; Y527-H668 AromaticContact CE1-CG 3.5Å; Y527-H668 AromaticContact CE1-ND1 3.88Å; Y527-H668 AromaticContact CG-CE1 3.45Å; Y527-H668 VanDerWaalsContact CG-CE1 3.45Å; Y527-H668 AromaticContact CG-CG 3.7Å; Y527-H668 AromaticContact CG-ND1 3.28Å; Y527-H668 VanDerWaalsContact CG-ND1 3.28Å; Y527-H668 AromaticContact CG-NE2 3.96Å
528	S	88.3	Confident	86.4	Confident	22 Å²	22	46 Å²	46	15%	0.154	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	165.6	168.7	78	0	0	0	0	111.3	Q117 E515 Q516 T526	Q117-S528 WeakPolarHBondContact CG-OG 3.49Å; Q117-S528 PolarHBondContact NE2-OG 2.65Å; E515-S528 VanDerWaalsContact OE1-CB 3.25Å; E515-S528 WeakPolarHBondContact OE1-CB 3.44Å; E515-S528 PolarHBondContact OE1-OG 3.05Å; Q516-S528 CarbonylContact O-C 3.55Å; Q516-S528 VanDerWaalsContact O-CA 3.24Å; Q516-S528 WeakPolarHBondContact O-CA 3.27Å; T526-S528 PolarHBondContact O-N 3.42Å
529	Q	87.8	Confident	86.4	Confident	19 Å²	19	49.4 Å²	49.4	9%	0.089	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	133.2	174.1	63	-173.6	82.1	0	0	111.6	Q516 R531 I662 A663 M665	Q516-Q529 HydrophobicContact CB-CG 4.19Å; Q516-Q529 PolarHBondContact N-O 2.79Å; Q516-Q529 PolarHBondContact O-N 3.15Å; Q529-R531 PolarHBondContact O-N 3.44Å; Q529-I662 HydrophobicContact CB-CD1 4.11Å; Q529-I662 HydrophobicContact CG-CD1 4.08Å; Q529-A663 PolarHBondContact NE2-O 3.46Å; Q529-M665 HydrophobicContact CG-CE 3.98Å
530	R	89.1	Confident	86.4	Confident	44 Å²	44	49.6 Å²	49.6	17%	0.166	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	108.4	176	-69.3	178.5	-142.1	112.3	36.8	110.3	E116 M514 E515 I662	E116-R530 PolarHBondContact O-NE 2.98Å; E116-R530 PolarHBondContact O-NH2 2.9Å; E116-R530 IonicContact OE2-CZ 2.78Å; E116-R530 IonicContact OE2-NH1 3.58Å; E116-R530 IonicContact OE2-NH2 3.55Å; E116-R530 PolarHBondContact OE2-NH2 2.65Å; M514-R530 CarbonylContact O-C 3.43Å; M514-R530 WeakPolarHBondContact O-CA 3.39Å; E515-R530 VanDerWaalsContact OE2-CG 3.29Å; E515-R530 WeakPolarHBondContact OE2-CG 3.41Å; E515-R530 IonicContact OE2-NE 2.69Å; E515-R530 PolarHBondContact OE2-NE 3.19Å; R530-I662 WeakPolarHBondContact O-CD1 3.21Å
531	R	89.8	Confident	86.5	Confident	64 Å²	64	48.7 Å²	48.7	24%	0.242	24%	0.236	C	C	.	.			trans	-78.6	-17.2	-172.6	-70.6	178.6	66	-154.5	5.7	115	W513 M514 Q516 Q529 F659 A660 I662	W513-R531 WeakPolarHBondContact O-CD 3.27Å; W513-R531 PolarHBondContact O-NH1 3.43Å; M514-R531 PolarHBondContact O-N 3.31Å; Q516-R531 HydrophobicContact CB-CG 3.86Å; Q529-R531 PolarHBondContact O-N 3.44Å; R531-F659 CarbonylContact O-C 3.6Å; R531-F659 WeakPolarHBondContact O-CA 3.39Å; R531-A660 PolarHBondContact O-N 3.46Å; R531-I662 HydrophobicContact CG-CD1 4.38Å
532	F	90.3	Very high	86.8	Confident	39 Å²	39	50.1 Å²	50.1	17%	0.171	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.6	-177	-61.9	-67.9	0	0	0	112.5	W513 M514 W657 K658 F659	W513-F532 HydrophobicContact CB-CE2 4.49Å; W513-F532 WeakPolarHBondContact O-CE2 3.41Å; M514-F532 HydrophobicContact CB-CD2 4.19Å; M514-F532 HydrophobicContact CG-CD2 4.35Å; F532-W657 HydrophobicContact CB-CE3 3.95Å; F532-K658 CarbonylContact C-O 3.58Å; F532-K658 VanDerWaalsContact CA-O 3.24Å; F532-K658 WeakPolarHBondContact CA-O 3.41Å; F532-F659 HydrophobicContact CD1-CD1 4Å; F532-F659 HydrophobicContact CD1-CE1 4.18Å; F532-F659 HydrophobicContact CD1-CG 4.46Å; F532-F659 AromaticContact CE1-CD1 3.52Å; F532-F659 HydrophobicContact CE1-CD1 3.52Å; F532-F659 HydrophobicContact CE1-CD2 4.45Å; F532-F659 AromaticContact CE1-CE1 3.26Å; F532-F659 HydrophobicContact CE1-CE1 3.26Å; F532-F659 HydrophobicContact CE1-CE2 4.25Å; F532-F659 HydrophobicContact CE1-CG 4.12Å; F532-F659 AromaticContact CE1-CZ 3.67Å; F532-F659 HydrophobicContact CE1-CZ 3.67Å; F532-F659 HydrophobicContact CZ-CD1 4.18Å; F532-F659 AromaticContact CZ-CE1 3.55Å; F532-F659 HydrophobicContact CZ-CE1 3.55Å; F532-F659 AromaticContact CZ-CZ 3.99Å; F532-F659 HydrophobicContact CZ-CZ 3.99Å
533	C	90.5	Very high	87.4	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.4	170.7	55.4	0	0	0	0	110.4	Q537 F539 K658 A660	C533-Q537 PolarHBondContact SG-OE1 3.42Å; C533-Q537 VanDerWaalsContact SG-OE1 3.38Å; C533-F539 WeakPolarHBondContact CB-O 3.31Å; C533-K658 PolarHBondContact N-O 2.59Å; C533-K658 PolarHBondContact O-N 3.37Å; C533-K658 PolarHBondContact SG-O 2.97Å; C533-A660 HydrophobicContact CB-CB 4.41Å
534	P	91.7	Very high	87.7	Confident	4 Å²	4	39.7 Å²	39.7	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	123	176.4	31.1	-33.2	0	0	0	110.6	V536 F539 I541 V552 V654 W657	P534-V536 PolarHBondContact O-N 3.13Å; P534-F539 WeakPolarHBondContact CD-O 3.43Å; P534-F539 HydrophobicContact CG-CB 4.07Å; P534-I541 HydrophobicContact CB-CD1 4.34Å; P534-I541 HydrophobicContact CG-CD1 3.93Å; P534-V552 HydrophobicContact CG-CG1 3.86Å; P534-V552 HydrophobicContact CG-CG2 4.07Å; P534-V654 HydrophobicContact CB-CB 4.45Å; P534-V654 HydrophobicContact CB-CG1 3.7Å; P534-V654 HydrophobicContact CB-CG2 3.85Å; P534-W657 HydrophobicContact CB-CE3 4.48Å; P534-W657 HydrophobicContact CB-CZ3 4.3Å
535	S	83.6	Confident	88	Confident	42 Å²	42	45.9 Å²	45.9	29%	0.294	22%	0.224	S	C	.	.	S	Bend	trans	62	-51	178.1	-50.6	0	0	0	0	117.2	E656 K658	S535-E656 WeakPolarHBondContact CA-O 3.49Å; S535-E656 PolarHBondContact N-O 3.41Å; S535-K658 PolarHBondContact O-NZ 3.31Å
536	V	84	Confident	88.1	Confident	72 Å²	72	51.5 Å²	51.5	44%	0.436	25%	0.249	S	C	.	.	S	Bend	trans	-138	153.6	-169.6	-75.1	0	0	0	0	111.8	P534 F539	P534-V536 PolarHBondContact O-N 3.13Å; V536-F539 HydrophobicContact CG2-CB 4.32Å; V536-F539 HydrophobicContact CG2-CD1 4.11Å; V536-F539 HydrophobicContact CG2-CD2 3.37Å; V536-F539 HydrophobicContact CG2-CE1 4.27Å; V536-F539 HydrophobicContact CG2-CE2 3.55Å; V536-F539 HydrophobicContact CG2-CG 3.68Å; V536-F539 HydrophobicContact CG2-CZ 4.01Å; V536-F539 PolarHBondContact O-N 3.1Å
537	Q	86.5	Confident	88.3	Confident	95 Å²	95	51.7 Å²	51.7	44%	0.444	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	151.2	178.3	-66.9	-60.7	-10.9	0	0	112.1	C533 F539 F659	C533-Q537 PolarHBondContact SG-OE1 3.42Å; C533-Q537 VanDerWaalsContact SG-OE1 3.38Å; Q537-F539 PolarHBondContact O-N 3.36Å; Q537-F659 PolarHBondContact NE2-O 3.49Å
538	G	81.4	Confident	88.4	Confident	40 Å²	40	48.5 Å²	48.5	41%	0.412	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-27.1	-176.1	0	0	0	0	0	114.5	G555	G538-G555 WeakPolarHBondContact O-CA 3.35Å; G538-G555 PolarHBondContact O-N 2.81Å
539	F	88.6	Confident	88.7	Confident	73 Å²	73	47.6 Å²	47.6	32%	0.32	23%	0.234	S	C	.	.			trans	-69.8	138.3	175.9	-76.8	-130.1	0	0	0	109.7	C533 P534 V536 Q537 V552 Q553 P554	C533-F539 WeakPolarHBondContact CB-O 3.31Å; P534-F539 WeakPolarHBondContact CD-O 3.43Å; P534-F539 HydrophobicContact CG-CB 4.07Å; V536-F539 HydrophobicContact CG2-CB 4.32Å; V536-F539 HydrophobicContact CG2-CD1 4.11Å; V536-F539 HydrophobicContact CG2-CD2 3.37Å; V536-F539 HydrophobicContact CG2-CE1 4.27Å; V536-F539 HydrophobicContact CG2-CE2 3.55Å; V536-F539 HydrophobicContact CG2-CG 3.68Å; V536-F539 HydrophobicContact CG2-CZ 4.01Å; V536-F539 PolarHBondContact O-N 3.1Å; Q537-F539 PolarHBondContact O-N 3.36Å; F539-V552 HydrophobicContact CB-CG1 4.45Å; F539-V552 HydrophobicContact CD1-CG1 3.74Å; F539-Q553 WeakPolarHBondContact CA-O 3.29Å; F539-P554 HydrophobicContact CD1-CB 4.36Å; F539-P554 HydrophobicContact CD1-CG 4.36Å; F539-P554 HydrophobicContact CD2-CB 4.34Å; F539-P554 HydrophobicContact CE1-CB 3.97Å; F539-P554 HydrophobicContact CE1-CG 3.85Å; F539-P554 HydrophobicContact CE2-CB 3.95Å; F539-P554 HydrophobicContact CZ-CB 3.76Å; F539-P554 HydrophobicContact CZ-CG 4.03Å
540	R	88.8	Confident	89	Confident	85 Å²	85	47 Å²	47	32%	0.321	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.9	-176.9	64.3	-169.7	-170.8	156.7	6.5	111.4	E116 I542 Q553	E116-R540 IonicContact OE1-CZ 3.81Å; E116-R540 IonicContact OE1-NH1 3.47Å; E116-R540 PolarHBondContact OE1-NH1 3.11Å; E116-R540 IonicContact OE1-NH2 3.56Å; E116-R540 PolarHBondContact OE1-NH2 3.35Å; E116-R540 IonicContact OE2-NH1 2.87Å; R540-I542 HydrophobicContact CG-CG2 4.39Å; R540-Q553 HydrophobicContact CG-CB 4.11Å; R540-Q553 VanDerWaalsContact CZ-OE1 3.25Å; R540-Q553 PolarHBondContact N-O 3.08Å; R540-Q553 PolarHBondContact O-N 3.26Å
541	I	91.6	Very high	89.2	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.4	167.7	-56.6	-60.2	0	0	0	108.4	L118 I506 P534 F550 G551 V552 F651 W657	L118-I541 HydrophobicContact CD1-CB 3.96Å; L118-I541 HydrophobicContact CD1-CG2 3.87Å; L118-I541 HydrophobicContact CD2-CG2 4.07Å; I506-I541 HydrophobicContact CD1-CD1 4.46Å; I506-I541 HydrophobicContact CD1-CG2 3.93Å; P534-I541 HydrophobicContact CB-CD1 4.34Å; P534-I541 HydrophobicContact CG-CD1 3.93Å; I541-F550 HydrophobicContact CG2-CB 4.38Å; I541-F550 HydrophobicContact CG2-CD1 3.99Å; I541-G551 WeakPolarHBondContact CA-O 3.28Å; I541-V552 HydrophobicContact CD1-CG2 3.87Å; I541-F651 HydrophobicContact CD1-CE2 4.44Å; I541-W657 HydrophobicContact CD1-CH2 3.71Å; I541-W657 HydrophobicContact CD1-CZ3 4.02Å; I541-W657 HydrophobicContact CG1-CH2 3.7Å; I541-W657 HydrophobicContact CG1-CZ3 3.74Å
542	I	91.4	Very high	89.3	Confident	44 Å²	44	43.4 Å²	43.4	23%	0.226	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	160.6	172.1	59.2	164.7	0	0	0	109.4	R540 F550 G551 Q553 F596	R540-I542 HydrophobicContact CG-CG2 4.39Å; I542-F550 CarbonylContact O-C 3.56Å; I542-F550 VanDerWaalsContact O-CA 3.28Å; I542-F550 WeakPolarHBondContact O-CA 3.26Å; I542-G551 WeakPolarHBondContact CG1-O 3.16Å; I542-G551 PolarHBondContact N-O 3.38Å; I542-G551 PolarHBondContact O-N 3.19Å; I542-Q553 HydrophobicContact CD1-CB 4.21Å; I542-Q553 HydrophobicContact CG1-CB 4.36Å; I542-Q553 HydrophobicContact CG2-CB 3.86Å; I542-F596 HydrophobicContact CD1-CE1 4.45Å
543	H	91.2	Very high	89.2	Confident	28 Å²	28	45 Å²	45	13%	0.13	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.2	170.3	179.9	-81.1	0	0	0	108.9	L118 A121 Q125 R545 F550	L118-H543 HydrophobicContact CD2-CB 4.21Å; A121-H543 HydrophobicContact CB-CB 3.84Å; Q125-H543 PolarHBondContact OE1-NE2 2.9Å; H543-R545 PolarHBondContact CE1-N 3.31Å; H543-F550 HydrophobicContact CB-CD1 4.01Å; H543-F550 HydrophobicContact CB-CE1 4.01Å; H543-F550 AromaticContact CD2-CD1 3.95Å; H543-F550 AromaticContact CD2-CE1 3.69Å; H543-F550 AromaticContact CD2-CZ 3.85Å
544	D	90.7	Very high	89	Confident	24 Å²	24	48.9 Å²	48.9	13%	0.128	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	120.6	174.6	-178.9	-84.1	0	0	0	110.8	H546 L547 G548 S549 F596 Q600	D544-H546 VanDerWaalsContact C-N 3.29Å; D544-H546 PolarHBondContact O-N 2.81Å; D544-H546 VanDerWaalsContact OD1-CA 3.31Å; D544-H546 WeakPolarHBondContact OD1-CA 3.35Å; D544-H546 VanDerWaalsContact OD1-CB 3.27Å; D544-H546 WeakPolarHBondContact OD1-CB 3.46Å; D544-H546 IonicContact OD1-CG 3.79Å; D544-H546 PolarHBondContact OD1-N 3.27Å; D544-H546 IonicContact OD1-ND1 3.85Å; D544-H546 IonicContact OD2-ND1 2.89Å; D544-L547 HydrophobicContact CB-CB 4.4Å; D544-L547 PolarHBondContact OD1-N 3.43Å; D544-G548 WeakPolarHBondContact O-CA 3.42Å; D544-G548 PolarHBondContact O-N 3.15Å; D544-S549 PolarHBondContact N-O 3.4Å; D544-S549 PolarHBondContact O-N 2.98Å; D544-F596 HydrophobicContact CB-CE2 4.13Å; D544-F596 HydrophobicContact CB-CZ 3.9Å; D544-Q600 PolarHBondContact OD2-NE2 3.09Å
545	R	86.3	Confident	88.2	Confident	137 Å²	137	50 Å²	50	52%	0.517	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.1	-178.7	176.8	177	168.8	-162.8	-10.2	113.9	H543	H543-R545 PolarHBondContact CE1-N 3.31Å
546	H	86.7	Confident	87.1	Confident	127 Å²	127	55.5 Å²	55.5	59%	0.588	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-42.4	-174.9	-55.7	90.7	0	0	0	112	D544 G548	D544-H546 VanDerWaalsContact C-N 3.29Å; D544-H546 PolarHBondContact O-N 2.81Å; D544-H546 VanDerWaalsContact OD1-CA 3.31Å; D544-H546 WeakPolarHBondContact OD1-CA 3.35Å; D544-H546 VanDerWaalsContact OD1-CB 3.27Å; D544-H546 WeakPolarHBondContact OD1-CB 3.46Å; D544-H546 IonicContact OD1-CG 3.79Å; D544-H546 PolarHBondContact OD1-N 3.27Å; D544-H546 IonicContact OD1-ND1 3.85Å; D544-H546 IonicContact OD2-ND1 2.89Å; H546-G548 VanDerWaalsContact C-N 3.31Å
547	L	88.9	Confident	85.6	Confident	41 Å²	41	57.6 Å²	57.6	22%	0.215	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.1	174	-61.2	177.8	0	0	0	112.1	D544 S549 F596 C599 Q600 T649	D544-L547 HydrophobicContact CB-CB 4.4Å; D544-L547 PolarHBondContact OD1-N 3.43Å; L547-S549 PolarHBondContact O-N 2.76Å; L547-F596 HydrophobicContact CD1-CD2 3.89Å; L547-F596 HydrophobicContact CD1-CE2 3.72Å; L547-F596 HydrophobicContact CD1-CZ 4.3Å; L547-C599 HydrophobicContact CD1-CB 3.98Å; L547-C599 HydrophobicContact CD2-CB 4.19Å; L547-Q600 HydrophobicContact CD1-CG 4.14Å; L547-T649 HydrophobicContact CB-CG2 4.25Å
548	G	89.8	Confident	83.7	Confident	14 Å²	14	60.7 Å²	60.7	14%	0.144	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	36.4	-176.1	0	0	0	0	0	112.7	Q125 Q488 D544 H546	Q125-G548 PolarHBondContact NE2-O 2.9Å; Q125-G548 PolarHBondContact OE1-O 2.97Å; Q488-G548 PolarHBondContact NE2-O 3.15Å; D544-G548 WeakPolarHBondContact O-CA 3.42Å; D544-G548 PolarHBondContact O-N 3.15Å; H546-G548 VanDerWaalsContact C-N 3.31Å
549	S	93.1	Very high	81.7	Confident	3 Å²	3	67 Å²	67	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.6	-167.9	-160.2	0	0	0	0	111.7	D544 L547 T649	D544-S549 PolarHBondContact N-O 3.4Å; D544-S549 PolarHBondContact O-N 2.98Å; L547-S549 PolarHBondContact O-N 2.76Å; S549-T649 PolarHBondContact OG-O 2.86Å
550	F	94.2	Very high	79.3	Confident	5 Å²	5	70.3 Å²	70.3	2%	0.022	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	154.8	170.4	-62.7	-79.9	0	0	0	111.3	L118 L122 V502 I506 H507 L510 I541 I542 H543 F596 F651	L118-F550 HydrophobicContact CB-CE1 4.42Å; L118-F550 HydrophobicContact CD2-CD1 4.26Å; L118-F550 HydrophobicContact CD2-CE1 4.17Å; L122-F550 HydrophobicContact CB-CZ 4.33Å; L122-F550 HydrophobicContact CD1-CE2 4.41Å; L122-F550 HydrophobicContact CD1-CZ 4.38Å; L122-F550 HydrophobicContact CD2-CE2 4.45Å; L122-F550 HydrophobicContact CD2-CZ 4.16Å; V502-F550 HydrophobicContact CG1-CD2 3.94Å; V502-F550 HydrophobicContact CG1-CE2 4.22Å; V502-F550 HydrophobicContact CG2-CD2 4.45Å; I506-F550 HydrophobicContact CD1-CB 3.96Å; I506-F550 HydrophobicContact CD1-CD1 4.39Å; I506-F550 HydrophobicContact CD1-CD2 4.39Å; I506-F550 HydrophobicContact CD1-CG 3.99Å; I506-F550 HydrophobicContact CG2-CD1 4.21Å; I506-F550 HydrophobicContact CG2-CD2 4.28Å; I506-F550 HydrophobicContact CG2-CE1 3.92Å; I506-F550 HydrophobicContact CG2-CE2 4Å; I506-F550 HydrophobicContact CG2-CG 4.38Å; I506-F550 HydrophobicContact CG2-CZ 3.81Å; H507-F550 AromaticContact NE2-CE2 3.82Å; L510-F550 HydrophobicContact CD1-CZ 4.23Å; I541-F550 HydrophobicContact CG2-CB 4.38Å; I541-F550 HydrophobicContact CG2-CD1 3.99Å; I542-F550 CarbonylContact O-C 3.56Å; I542-F550 VanDerWaalsContact O-CA 3.28Å; I542-F550 WeakPolarHBondContact O-CA 3.26Å; H543-F550 HydrophobicContact CB-CD1 4.01Å; H543-F550 HydrophobicContact CB-CE1 4.01Å; H543-F550 AromaticContact CD2-CD1 3.95Å; H543-F550 AromaticContact CD2-CE1 3.69Å; H543-F550 AromaticContact CD2-CZ 3.85Å; F550-F596 WeakPolarHBondContact O-CD2 3.35Å; F550-F596 WeakPolarHBondContact O-CE2 3.35Å; F550-F651 HydrophobicContact CB-CE1 3.9Å; F550-F651 WeakPolarHBondContact O-CD1 3.38Å
551	G	93.4	Very high	77.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	172.2	172.8	0	0	0	0	0	111.9	I541 I542	I541-G551 WeakPolarHBondContact CA-O 3.28Å; I542-G551 WeakPolarHBondContact CG1-O 3.16Å; I542-G551 PolarHBondContact N-O 3.38Å; I542-G551 PolarHBondContact O-N 3.19Å
552	V	92.5	Very high	74.3	Confident	33 Å²	33	75.7 Å²	75.7	20%	0.2	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.6	176.1	176.6	0	0	0	0	109.1	P534 F539 I541 F651	P534-V552 HydrophobicContact CG-CG1 3.86Å; P534-V552 HydrophobicContact CG-CG2 4.07Å; F539-V552 HydrophobicContact CB-CG1 4.45Å; F539-V552 HydrophobicContact CD1-CG1 3.74Å; I541-V552 HydrophobicContact CD1-CG2 3.87Å; V552-F651 HydrophobicContact CB-CD2 4.5Å; V552-F651 HydrophobicContact CG2-CD2 3.45Å; V552-F651 VanDerWaalsContact CG2-CD2 3.45Å; V552-F651 HydrophobicContact CG2-CE2 3.57Å; V552-F651 HydrophobicContact CG2-CG 4.42Å
553	Q	89.3	Confident	71.9	Confident	74 Å²	74	79.9 Å²	79.9	35%	0.346	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.7	171.1	-168.7	178.5	39.9	0	0	109.4	F539 R540 I542 G555	F539-Q553 WeakPolarHBondContact CA-O 3.29Å; R540-Q553 HydrophobicContact CG-CB 4.11Å; R540-Q553 VanDerWaalsContact CZ-OE1 3.25Å; R540-Q553 PolarHBondContact N-O 3.08Å; R540-Q553 PolarHBondContact O-N 3.26Å; I542-Q553 HydrophobicContact CD1-CB 4.21Å; I542-Q553 HydrophobicContact CG1-CB 4.36Å; I542-Q553 HydrophobicContact CG2-CB 3.86Å; Q553-G555 PolarHBondContact O-N 3.28Å
554	P	86.2	Confident	69.3	Low	83 Å²	83	85.8 Å²	85.8	54%	0.539	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-61.7	124.7	165.1	-19.5	32.4	0	0	0	109.5	F539	F539-P554 HydrophobicContact CD1-CB 4.36Å; F539-P554 HydrophobicContact CD1-CG 4.36Å; F539-P554 HydrophobicContact CD2-CB 4.34Å; F539-P554 HydrophobicContact CE1-CB 3.97Å; F539-P554 HydrophobicContact CE1-CG 3.85Å; F539-P554 HydrophobicContact CE2-CB 3.95Å; F539-P554 HydrophobicContact CZ-CB 3.76Å; F539-P554 HydrophobicContact CZ-CG 4.03Å
555	G	74.7	Confident	67.1	Low	26 Å²	26	90 Å²	90	27%	0.268	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-77	148.7	172	0	0	0	0	0	111.4	G538 Q553	G538-G555 WeakPolarHBondContact O-CA 3.35Å; G538-G555 PolarHBondContact O-N 2.81Å; Q553-G555 PolarHBondContact O-N 3.28Å
556	L	60.9	Low	64.9	Low	159 Å²	159	92.7 Å²	92.7	83%	0.832	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-58.9	136.6	164.3	-72.2	165.6	0	0	0	108.9	L558	L556-L558 PolarHBondContact O-N 3.14Å; L556-L558 VanDerWaalsContact O-N 3.13Å
557	P	50.6	Low	62.6	Low	116 Å²	116	94.9 Å²	94.9	75%	0.753	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-57.2	121.9	172.8	-22	32.2	0	0	0	109.4	K559	P557-K559 PolarHBondContact O-N 3.15Å
558	L	47.9	Very low	60.2	Low	159 Å²	159	98.7 Å²	98.7	83%	0.832	56%	0.556	S	S	*	*			trans	-58.7	110.3	166.7	-98.6	75.9	0	0	0	107	L556 T560	L556-L558 PolarHBondContact O-N 3.14Å; L556-L558 VanDerWaalsContact O-N 3.13Å; L558-T560 PolarHBondContact O-N 2.92Å
559	K	39.7	Very low	57.9	Low	174 Å²	174	105.8 Å²	105.8	76%	0.757	59%	0.585	S	S	*	*			trans	-67.8	101	166.2	-74.5	-164.3	175.6	-169.6	0	107.1	P557 G561	P557-K559 PolarHBondContact O-N 3.15Å; K559-G561 PolarHBondContact O-N 3.24Å
560	T	37.8	Very low	55.5	Low	141 Å²	141	114.7 Å²	114.7	87%	0.865	63%	0.626	S	S	*	*			trans	-60.8	115	179.2	-43.5	0	0	0	0	109.8	L558	L558-T560 PolarHBondContact O-N 2.92Å
561	G	42.4	Very low	53.4	Low	67 Å²	67	121.1 Å²	121.1	69%	0.691	66%	0.659	S	S	*	*	S	Bend	trans	68.3	80.1	165.8	0	0	0	0	0	116	K559	K559-G561 PolarHBondContact O-N 3.24Å
562	D	32.3	Very low	51.1	Low	135 Å²	135	128 Å²	128	72%	0.722	70%	0.696	S	S	*	*			trans	-150.1	98.8	144.4	-102.8	-31	0	0	0	109.7	H564	D562-H564 PolarHBondContact O-N 3.44Å; D562-H564 IonicContact OD1-CD2 2.66Å
563	S	40.5	Very low	49.1	Very low	132 Å²	132	130.4 Å²	130.4	92%	0.923	72%	0.719	S	S	*	*			trans	-80.3	47.7	169.4	-66.7	0	0	0	0	111.3
564	H	36.8	Very low	47.6	Very low	152 Å²	152	134.7 Å²	134.7	70%	0.704	74%	0.739	S	S	*	*			trans	-90.6	121	161.9	-76.6	-66.5	0	0	0	108.6	D562 R566	D562-H564 PolarHBondContact O-N 3.44Å; D562-H564 IonicContact OD1-CD2 2.66Å; H564-R566 PolarHBondContact O-N 3.36Å
565	S	45.7	Very low	46.2	Very low	112 Å²	112	140.2 Å²	140.2	78%	0.783	75%	0.75	S	S	*	*			trans	-51.1	102.5	168.9	176.9	0	0	0	0	108.7	K567	S565-K567 PolarHBondContact O-N 3.17Å
566	R	38.9	Very low	46.1	Very low	194 Å²	194	143.2 Å²	143.2	73%	0.732	76%	0.76	S	S	*	*			trans	-68.4	95.2	162.6	-72.3	-170.1	-172.1	156.8	11.8	105.6	H564	H564-R566 PolarHBondContact O-N 3.36Å
567	K	39.5	Very low	47.2	Very low	172 Å²	172	142.9 Å²	142.9	75%	0.748	76%	0.755	S	S	*	*			trans	-43.3	137.4	149.9	-67	-173.1	177.1	-174.2	0	106.5	S565 H569	S565-K567 PolarHBondContact O-N 3.17Å; K567-H569 VanDerWaalsContact C-N 3.33Å; K567-H569 PolarHBondContact O-N 3.34Å
568	P	38.1	Very low	49	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	74%	0.738	S	S	*	*			trans	-58.8	105.6	173.6	25.7	-32.3	0	0	0	106.6	H570	P568-H570 PolarHBondContact O-N 2.87Å; P568-H570 VanDerWaalsContact O-N 3.16Å
569	H	41.1	Very low	50.9	Low	162 Å²	162	135.4 Å²	135.4	75%	0.75	71%	0.707	S	S	*	*			trans	-56.2	124.1	157.3	-78.9	-84.2	0	0	0	104.2	K567 I571	K567-H569 VanDerWaalsContact C-N 3.33Å; K567-H569 PolarHBondContact O-N 3.34Å; H569-I571 VanDerWaalsContact C-N 3.34Å; H569-I571 PolarHBondContact O-N 3.03Å
570	H	43	Very low	53.3	Low	190 Å²	190	133.1 Å²	133.1	88%	0.88	70%	0.703	S	S	*	*			trans	-48.8	109.6	165.4	-87.9	-103.1	0	0	0	106.1	P568 D572	P568-H570 PolarHBondContact O-N 2.87Å; P568-H570 VanDerWaalsContact O-N 3.16Å; H570-D572 PolarHBondContact O-N 2.81Å
571	I	49.8	Very low	55.9	Low	141 Å²	141	129.5 Å²	129.5	72%	0.723	68%	0.678	S	S	*	*			trans	-73.9	79.7	164	-59.7	178.3	0	0	0	103.1	H569 A573 Q574	H569-I571 VanDerWaalsContact C-N 3.34Å; H569-I571 PolarHBondContact O-N 3.03Å; I571-A573 PolarHBondContact O-N 3.36Å; I571-A573 VanDerWaalsContact O-N 3.15Å; I571-Q574 HydrophobicContact CG2-CG 4.35Å
572	D	44.4	Very low	58.5	Low	145 Å²	145	129.9 Å²	129.9	78%	0.775	67%	0.668	S	S	*	*			trans	-43.9	120.2	162	-168.5	22.9	0	0	0	106.2	H570 Q574	H570-D572 PolarHBondContact O-N 2.81Å; D572-Q574 VanDerWaalsContact C-N 3.35Å; D572-Q574 WeakPolarHBondContact O-CG 3.38Å; D572-Q574 PolarHBondContact O-N 2.94Å
573	A	52.1	Low	61.5	Low	82 Å²	82	127.2 Å²	127.2	68%	0.678	65%	0.65	S	S	*	*			trans	-56.8	95.3	-150.7	0	0	0	0	0	110.8	I571 Y575	I571-A573 PolarHBondContact O-N 3.36Å; I571-A573 VanDerWaalsContact O-N 3.15Å; A573-Y575 PolarHBondContact O-N 3.29Å
574	Q	57.6	Low	64.2	Low	165 Å²	165	127 Å²	127	77%	0.771	64%	0.635	S	S	*	*			trans	-69.5	103.1	-170.4	-77.9	-168.7	1.4	0	0	107.6	I571 D572 D576	I571-Q574 HydrophobicContact CG2-CG 4.35Å; D572-Q574 VanDerWaalsContact C-N 3.35Å; D572-Q574 WeakPolarHBondContact O-CG 3.38Å; D572-Q574 PolarHBondContact O-N 2.94Å; Q574-D576 PolarHBondContact O-N 3.42Å
575	Y	56.9	Low	67.1	Low	198 Å²	198	122.7 Å²	122.7	78%	0.776	62%	0.619	S	S	*	*			trans	-35.1	134.9	173.1	-72.5	-94.5	0	0	0	110.3	A573 Q577	A573-Y575 PolarHBondContact O-N 3.29Å; Y575-Q577 WeakPolarHBondContact O-CG 3.4Å; Y575-Q577 PolarHBondContact O-N 3.3Å
576	D	72.3	Confident	69.5	Low	90 Å²	90	117.6 Å²	117.6	48%	0.481	58%	0.583	S	S	.	*			trans	-64.4	81.8	175.5	-178.8	-0.2	0	0	0	110	Q574 F578 S579 N580	Q574-D576 PolarHBondContact O-N 3.42Å; D576-F578 PolarHBondContact O-N 3.47Å; D576-F578 PolarHBondContact OD1-N 3Å; D576-S579 PolarHBondContact OD1-N 3.08Å; D576-S579 WeakPolarHBondContact OD2-CB 3.27Å; D576-S579 PolarHBondContact OD2-OG 3.41Å; D576-N580 PolarHBondContact O-N 3.07Å; D576-N580 PolarHBondContact O-ND2 3.2Å
577	Q	83.7	Confident	72.2	Confident	152 Å²	152	111.3 Å²	111.3	71%	0.71	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-21.2	178.9	-72.3	176.1	9.3	0	0	111.1	Y575	Y575-Q577 WeakPolarHBondContact O-CG 3.4Å; Y575-Q577 PolarHBondContact O-N 3.3Å
578	F	88.3	Confident	75	Confident	90 Å²	90	108.5 Å²	108.5	40%	0.395	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	-51.8	179.6	-176.1	-103.2	0	0	0	111.2	D576 N580 L581 L586 I589 M608	D576-F578 PolarHBondContact O-N 3.47Å; D576-F578 PolarHBondContact OD1-N 3Å; F578-N580 PolarHBondContact O-N 3.16Å; F578-N580 VanDerWaalsContact O-N 3.15Å; F578-L581 HydrophobicContact CD2-CD1 3.87Å; F578-L581 HydrophobicContact CE2-CD1 4.22Å; F578-L581 WeakPolarHBondContact O-CB 3.43Å; F578-L581 WeakPolarHBondContact O-CG 3.08Å; F578-L581 PolarHBondContact O-N 3.49Å; F578-L586 HydrophobicContact CD1-CD2 4.23Å; F578-L586 HydrophobicContact CD2-CD2 4.36Å; F578-L586 HydrophobicContact CE1-CD2 3.8Å; F578-L586 HydrophobicContact CE2-CD2 3.95Å; F578-L586 HydrophobicContact CG-CD2 4.5Å; F578-L586 HydrophobicContact CZ-CD2 3.64Å; F578-L586 WeakPolarHBondContact O-CD2 3.49Å; F578-I589 HydrophobicContact CE2-CD1 4.1Å; F578-I589 HydrophobicContact CE2-CG2 4.39Å; F578-I589 HydrophobicContact CZ-CG2 4.34Å; F578-M608 HydrophobicContact CD1-CE 3.58Å; F578-M608 HydrophobicContact CD1-SD 4.47Å; F578-M608 HydrophobicContact CE1-CE 3.51Å; F578-M608 HydrophobicContact CE1-SD 3.84Å
579	S	88.1	Confident	77.7	Confident	27 Å²	27	105.8 Å²	105.8	19%	0.189	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.9	176.8	-62.6	0	0	0	0	113.9	D576 M608	D576-S579 PolarHBondContact OD1-N 3.08Å; D576-S579 WeakPolarHBondContact OD2-CB 3.27Å; D576-S579 PolarHBondContact OD2-OG 3.41Å; S579-M608 WeakPolarHBondContact OG-CE 3.15Å
580	N	89.1	Confident	80.3	Confident	127 Å²	127	98.1 Å²	98.1	68%	0.679	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.9	174.2	-74.2	-47.8	0	0	0	114.1	D576 F578	D576-N580 PolarHBondContact O-N 3.07Å; D576-N580 PolarHBondContact O-ND2 3.2Å; F578-N580 PolarHBondContact O-N 3.16Å; F578-N580 VanDerWaalsContact O-N 3.15Å
581	L	94	Very high	82.8	Confident	64 Å²	64	90.4 Å²	90.4	34%	0.335	46%	0.462	S	S	.	.	S	Bend	trans	-67.1	149.1	173	-66.6	174.1	0	0	0	111.1	F578 V585 L586 I589	F578-L581 HydrophobicContact CD2-CD1 3.87Å; F578-L581 HydrophobicContact CE2-CD1 4.22Å; F578-L581 WeakPolarHBondContact O-CB 3.43Å; F578-L581 WeakPolarHBondContact O-CG 3.08Å; F578-L581 PolarHBondContact O-N 3.49Å; L581-V585 HydrophobicContact CB-CG1 4.45Å; L581-V585 HydrophobicContact CD1-CG1 4.3Å; L581-L586 HydrophobicContact CB-CD2 3.99Å; L581-L586 HydrophobicContact CB-CG 3.94Å; L581-L586 HydrophobicContact CD1-CD2 4.16Å; L581-L586 WeakPolarHBondContact O-CD1 3.39Å; L581-I589 HydrophobicContact CD1-CD1 4.18Å
582	P	96	Very high	84.9	Confident	75 Å²	75	90.8 Å²	90.8	49%	0.487	46%	0.458	S	S	.	.			trans	-54.5	146.6	174.7	-25.4	34.2	0	0	0	112.5	E584 V585 L586	P582-E584 PolarHBondContact O-N 3.08Å; P582-V585 HydrophobicContact CB-CG2 4.12Å; P582-V585 HydrophobicContact CG-CG2 4.24Å; P582-V585 WeakPolarHBondContact O-CB 3.46Å; P582-V585 PolarHBondContact O-N 3.38Å; P582-L586 PolarHBondContact O-N 3.14Å
583	F	96.4	Very high	87.3	Confident	79 Å²	79	86.4 Å²	86.4	35%	0.346	44%	0.435	S	S	.	.	H	α-helix	trans	-56.5	-39.3	-174.4	-179.1	-90.8	0	0	0	112.3	V585 L586 Q587 N610 V611	F583-V585 VanDerWaalsContact C-N 3.32Å; F583-V585 PolarHBondContact O-N 3.47Å; F583-L586 PolarHBondContact O-N 2.9Å; F583-Q587 HydrophobicContact CE1-CB 4.34Å; F583-Q587 VanDerWaalsContact O-CB 3.27Å; F583-Q587 WeakPolarHBondContact O-CB 3.45Å; F583-Q587 PolarHBondContact O-N 3.4Å; F583-N610 HydrophobicContact CE2-CB 4.45Å; F583-V611 HydrophobicContact CD2-CG2 3.71Å; F583-V611 HydrophobicContact CE2-CB 4.23Å; F583-V611 HydrophobicContact CE2-CG2 3.52Å; F583-V611 HydrophobicContact CZ-CG2 4.31Å
584	E	96.6	Very high	89.3	Confident	128 Å²	128	84.5 Å²	84.5	60%	0.598	41%	0.413	S	S	*	.	H	α-helix	trans	-65.7	-35.9	179.4	-58.9	70.8	-155.8	0	0	111.6	P582 H588	P582-E584 PolarHBondContact O-N 3.08Å; E584-H588 VanDerWaalsContact O-CB 3.27Å; E584-H588 WeakPolarHBondContact O-CB 3.36Å; E584-H588 PolarHBondContact O-N 3.08Å
585	V	96.7	Very high	91.2	Very high	62 Å²	62	77 Å²	77	38%	0.376	38%	0.379	S	S	.	.	H	α-helix	trans	-69.5	-45.2	175.7	178.7	0	0	0	0	109.7	L581 P582 F583 H588 I589	L581-V585 HydrophobicContact CB-CG1 4.45Å; L581-V585 HydrophobicContact CD1-CG1 4.3Å; P582-V585 HydrophobicContact CB-CG2 4.12Å; P582-V585 HydrophobicContact CG-CG2 4.24Å; P582-V585 WeakPolarHBondContact O-CB 3.46Å; P582-V585 PolarHBondContact O-N 3.38Å; F583-V585 VanDerWaalsContact C-N 3.32Å; F583-V585 PolarHBondContact O-N 3.47Å; V585-H588 PolarHBondContact O-N 2.96Å; V585-I589 HydrophobicContact CG1-CD1 3.92Å; V585-I589 VanDerWaalsContact O-CG1 3.27Å; V585-I589 WeakPolarHBondContact O-CG1 3.39Å; V585-I589 PolarHBondContact O-N 3.24Å
586	L	96.8	Very high	93	Very high	4 Å²	4	67.9 Å²	67.9	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-41.9	175.1	-69.6	176.3	0	0	0	112.3	F578 L581 P582 F583 I589 A590 T607 M608 V611	F578-L586 HydrophobicContact CD1-CD2 4.23Å; F578-L586 HydrophobicContact CD2-CD2 4.36Å; F578-L586 HydrophobicContact CE1-CD2 3.8Å; F578-L586 HydrophobicContact CE2-CD2 3.95Å; F578-L586 HydrophobicContact CG-CD2 4.5Å; F578-L586 HydrophobicContact CZ-CD2 3.64Å; F578-L586 WeakPolarHBondContact O-CD2 3.49Å; L581-L586 HydrophobicContact CB-CD2 3.99Å; L581-L586 HydrophobicContact CB-CG 3.94Å; L581-L586 HydrophobicContact CD1-CD2 4.16Å; L581-L586 WeakPolarHBondContact O-CD1 3.39Å; P582-L586 PolarHBondContact O-N 3.14Å; F583-L586 PolarHBondContact O-N 2.9Å; L586-I589 PolarHBondContact O-N 3.49Å; L586-A590 VanDerWaalsContact O-CB 3.27Å; L586-A590 WeakPolarHBondContact O-CB 3.5Å; L586-A590 PolarHBondContact O-N 3.41Å; L586-T607 HydrophobicContact CD1-CG2 4.37Å; L586-M608 HydrophobicContact CD1-CE 3.75Å; L586-M608 HydrophobicContact CD1-SD 4.41Å; L586-M608 HydrophobicContact CD2-CE 3.84Å; L586-M608 HydrophobicContact CD2-SD 4.36Å; L586-M608 HydrophobicContact CG-CE 4.42Å; L586-V611 HydrophobicContact CB-CG1 4.07Å; L586-V611 HydrophobicContact CB-CG2 3.8Å; L586-V611 HydrophobicContact CD1-CG2 4.26Å
587	Q	96.6	Very high	94.1	Very high	63 Å²	63	65.3 Å²	65.3	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-41.4	175.6	-172.4	-176.2	30.2	0	0	111.5	F583 A590 S591 V611 S614 L615	F583-Q587 HydrophobicContact CE1-CB 4.34Å; F583-Q587 VanDerWaalsContact O-CB 3.27Å; F583-Q587 WeakPolarHBondContact O-CB 3.45Å; F583-Q587 PolarHBondContact O-N 3.4Å; Q587-A590 PolarHBondContact O-N 3.06Å; Q587-S591 WeakPolarHBondContact O-CB 3.39Å; Q587-S591 PolarHBondContact O-N 3.27Å; Q587-V611 HydrophobicContact CB-CG1 4.4Å; Q587-S614 WeakPolarHBondContact CG-OG 3.26Å; Q587-S614 PolarHBondContact NE2-OG 3.22Å; Q587-L615 HydrophobicContact CG-CD2 3.9Å; Q587-L615 HydrophobicContact CG-CG 4.41Å
588	H	96.5	Very high	94.7	Very high	113 Å²	113	58 Å²	58	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-46.1	174.7	-174.3	57.7	0	0	0	111.6	E584 V585 S591 F592	E584-H588 VanDerWaalsContact O-CB 3.27Å; E584-H588 WeakPolarHBondContact O-CB 3.36Å; E584-H588 PolarHBondContact O-N 3.08Å; V585-H588 PolarHBondContact O-N 2.96Å; H588-S591 WeakPolarHBondContact O-CB 3.36Å; H588-S591 PolarHBondContact O-N 2.82Å; H588-S591 VanDerWaalsContact O-N 3.1Å; H588-S591 PolarHBondContact O-OG 3.49Å; H588-F592 AromaticContact CD2-CE2 3.88Å; H588-F592 AromaticContact CE1-CE2 3.59Å; H588-F592 AromaticContact CE1-CZ 3.62Å; H588-F592 AromaticContact ND1-CE2 3.99Å; H588-F592 AromaticContact NE2-CE2 3.5Å; H588-F592 WeakPolarHBondContact NE2-CE2 3.33Å; H588-F592 AromaticContact NE2-CZ 3.72Å; H588-F592 WeakPolarHBondContact O-CD2 3.46Å; H588-F592 WeakPolarHBondContact O-CE2 3.34Å
589	I	95.8	Very high	95	Very high	64 Å²	64	54.7 Å²	54.7	33%	0.328	29%	0.286	S	S	.	.	H	α-helix	trans	-60.2	-48.6	175.6	-68.4	166.4	0	0	0	110.9	F578 L581 V585 L586 S591 F592	F578-I589 HydrophobicContact CE2-CD1 4.1Å; F578-I589 HydrophobicContact CE2-CG2 4.39Å; F578-I589 HydrophobicContact CZ-CG2 4.34Å; L581-I589 HydrophobicContact CD1-CD1 4.18Å; V585-I589 HydrophobicContact CG1-CD1 3.92Å; V585-I589 VanDerWaalsContact O-CG1 3.27Å; V585-I589 WeakPolarHBondContact O-CG1 3.39Å; V585-I589 PolarHBondContact O-N 3.24Å; L586-I589 PolarHBondContact O-N 3.49Å; I589-S591 PolarHBondContact O-N 3.27Å; I589-F592 PolarHBondContact O-N 2.91Å
590	A	96.4	Very high	95.3	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-27.3	176.1	0	0	0	0	0	112.4	L586 Q587 F592 L593 L598 L601 V611 L615	L586-A590 VanDerWaalsContact O-CB 3.27Å; L586-A590 WeakPolarHBondContact O-CB 3.5Å; L586-A590 PolarHBondContact O-N 3.41Å; Q587-A590 PolarHBondContact O-N 3.06Å; A590-F592 PolarHBondContact O-N 3.16Å; A590-L593 WeakPolarHBondContact O-CB 3.36Å; A590-L593 PolarHBondContact O-N 3.31Å; A590-L598 HydrophobicContact CB-CD2 4.03Å; A590-L601 HydrophobicContact CB-CD2 4.27Å; A590-V611 HydrophobicContact CB-CG1 3.8Å; A590-L615 HydrophobicContact CB-CD1 3.71Å
591	S	95.3	Very high	95.6	Very high	29 Å²	29	50.9 Å²	50.9	20%	0.203	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.6	173.8	86.9	0	0	0	0	114.7	Q587 H588 I589 R619	Q587-S591 WeakPolarHBondContact O-CB 3.39Å; Q587-S591 PolarHBondContact O-N 3.27Å; H588-S591 WeakPolarHBondContact O-CB 3.36Å; H588-S591 PolarHBondContact O-N 2.82Å; H588-S591 VanDerWaalsContact O-N 3.1Å; H588-S591 PolarHBondContact O-OG 3.49Å; I589-S591 PolarHBondContact O-N 3.27Å; S591-R619 PolarHBondContact O-NH1 2.84Å; S591-R619 PolarHBondContact O-NH2 3.43Å
592	F	94.3	Very high	95.6	Very high	148 Å²	148	49.2 Å²	49.2	65%	0.649	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-8.9	168.3	-62.7	-78.6	0	0	0	113.6	H588 I589 A590	H588-F592 AromaticContact CD2-CE2 3.88Å; H588-F592 AromaticContact CE1-CE2 3.59Å; H588-F592 AromaticContact CE1-CZ 3.62Å; H588-F592 AromaticContact ND1-CE2 3.99Å; H588-F592 AromaticContact NE2-CE2 3.5Å; H588-F592 WeakPolarHBondContact NE2-CE2 3.33Å; H588-F592 AromaticContact NE2-CZ 3.72Å; H588-F592 WeakPolarHBondContact O-CD2 3.46Å; H588-F592 WeakPolarHBondContact O-CE2 3.34Å; I589-F592 PolarHBondContact O-N 2.91Å; A590-F592 PolarHBondContact O-N 3.16Å
593	L	94.7	Very high	95.5	Very high	54 Å²	54	51.5 Å²	51.5	28%	0.283	26%	0.255	S	S	.	.	S	Bend	trans	-83	151.7	-179.1	-59.1	-179.1	0	0	0	112.3	A590 L598 L601 R619	A590-L593 WeakPolarHBondContact O-CB 3.36Å; A590-L593 PolarHBondContact O-N 3.31Å; L593-L598 HydrophobicContact CB-CD2 4.06Å; L593-L598 HydrophobicContact CB-CG 3.92Å; L593-L598 HydrophobicContact CD1-CD2 4.33Å; L593-L601 HydrophobicContact CD1-CD2 3.58Å; L593-R619 PolarHBondContact O-NH1 3.19Å
594	D	94.2	Very high	95.3	Very high	41 Å²	41	53 Å²	53	22%	0.219	27%	0.27	C	S	.	.			trans	-82.7	170.1	171.7	64.3	25.5	0	0	0	111.9	F596 S597 L598 F651 G652	D594-F596 VanDerWaalsContact C-N 3.29Å; D594-F596 PolarHBondContact O-N 3.44Å; D594-F596 PolarHBondContact OD1-N 3.3Å; D594-S597 PolarHBondContact O-N 2.89Å; D594-S597 VanDerWaalsContact OD1-CB 3.28Å; D594-S597 WeakPolarHBondContact OD1-CB 3.36Å; D594-S597 PolarHBondContact OD1-N 2.95Å; D594-S597 PolarHBondContact OD1-OG 3.2Å; D594-L598 WeakPolarHBondContact O-CB 3.46Å; D594-L598 VanDerWaalsContact O-CG 3.3Å; D594-L598 WeakPolarHBondContact O-CG 3.49Å; D594-L598 PolarHBondContact O-N 3.17Å; D594-F651 VanDerWaalsContact OD2-CA 3.25Å; D594-F651 WeakPolarHBondContact OD2-CA 3.31Å; D594-G652 PolarHBondContact OD2-N 3.06Å
595	S	95.6	Very high	95.1	Very high	9 Å²	9	48.4 Å²	48.4	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-36.9	-176.5	-65.6	0	0	0	0	112.5	E494 C599 S648	E494-S595 WeakPolarHBondContact OE1-CB 3.42Å; E494-S595 PolarHBondContact OE1-OG 2.79Å; S595-C599 PolarHBondContact O-N 3.49Å; S595-C599 PolarHBondContact O-SG 3.18Å; S595-C599 VanDerWaalsContact O-SG 3.39Å; S595-S648 CarbonylContact C-O 3.5Å; S595-S648 WeakPolarHBondContact CB-O 3.48Å; S595-S648 WeakPolarHBondContact CB-OG 3.38Å
596	F	95.7	Very high	95	Very high	5 Å²	5	55.4 Å²	55.4	2%	0.022	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-50	173.6	180	-85.1	0	0	0	112.7	I542 D544 L547 F550 D594 L598 C599 Q600 A650 F651	I542-F596 HydrophobicContact CD1-CE1 4.45Å; D544-F596 HydrophobicContact CB-CE2 4.13Å; D544-F596 HydrophobicContact CB-CZ 3.9Å; L547-F596 HydrophobicContact CD1-CD2 3.89Å; L547-F596 HydrophobicContact CD1-CE2 3.72Å; L547-F596 HydrophobicContact CD1-CZ 4.3Å; F550-F596 WeakPolarHBondContact O-CD2 3.35Å; F550-F596 WeakPolarHBondContact O-CE2 3.35Å; D594-F596 VanDerWaalsContact C-N 3.29Å; D594-F596 PolarHBondContact O-N 3.44Å; D594-F596 PolarHBondContact OD1-N 3.3Å; F596-L598 VanDerWaalsContact C-N 3.33Å; F596-L598 PolarHBondContact O-N 2.91Å; F596-C599 WeakPolarHBondContact O-CB 3.41Å; F596-C599 PolarHBondContact O-N 2.93Å; F596-Q600 HydrophobicContact CE1-CG 4.17Å; F596-Q600 PolarHBondContact O-N 3.09Å; F596-A650 WeakPolarHBondContact CB-O 3.42Å; F596-A650 PolarHBondContact N-O 3.43Å; F596-F651 HydrophobicContact CB-CB 3.95Å; F596-F651 HydrophobicContact CG-CB 4.36Å
597	S	95.6	Very high	94.9	Very high	36 Å²	36	58.3 Å²	58.3	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-35.8	177.6	-70.7	0	0	0	0	112.1	D594 Q600 L601	D594-S597 PolarHBondContact O-N 2.89Å; D594-S597 VanDerWaalsContact OD1-CB 3.28Å; D594-S597 WeakPolarHBondContact OD1-CB 3.36Å; D594-S597 PolarHBondContact OD1-N 2.95Å; D594-S597 PolarHBondContact OD1-OG 3.2Å; S597-Q600 PolarHBondContact O-N 3.14Å; S597-L601 WeakPolarHBondContact O-CB 3.25Å; S597-L601 PolarHBondContact O-N 2.88Å
598	L	96.3	Very high	94.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-39.7	174	-72.8	169.9	0	0	0	112.4	A590 L593 D594 F596 Q600 S602 L615 F647	A590-L598 HydrophobicContact CB-CD2 4.03Å; L593-L598 HydrophobicContact CB-CD2 4.06Å; L593-L598 HydrophobicContact CB-CG 3.92Å; L593-L598 HydrophobicContact CD1-CD2 4.33Å; D594-L598 WeakPolarHBondContact O-CB 3.46Å; D594-L598 VanDerWaalsContact O-CG 3.3Å; D594-L598 WeakPolarHBondContact O-CG 3.49Å; D594-L598 PolarHBondContact O-N 3.17Å; F596-L598 VanDerWaalsContact C-N 3.33Å; F596-L598 PolarHBondContact O-N 2.91Å; L598-Q600 VanDerWaalsContact C-N 3.33Å; L598-Q600 PolarHBondContact O-N 3.35Å; L598-S602 WeakPolarHBondContact O-CB 3.5Å; L598-S602 PolarHBondContact O-N 3.21Å; L598-L615 HydrophobicContact CD2-CD1 4.18Å; L598-F647 HydrophobicContact CB-CD1 4.24Å; L598-F647 HydrophobicContact CB-CD2 3.91Å; L598-F647 HydrophobicContact CB-CE1 4.35Å; L598-F647 HydrophobicContact CB-CE2 4.03Å; L598-F647 HydrophobicContact CB-CG 4.02Å; L598-F647 HydrophobicContact CB-CZ 4.25Å; L598-F647 HydrophobicContact CD1-CD1 3.97Å; L598-F647 HydrophobicContact CD1-CE1 3.67Å; L598-F647 HydrophobicContact CD1-CZ 4.03Å
599	C	95.4	Very high	94.8	Very high	20 Å²	20	53.8 Å²	53.8	14%	0.135	27%	0.266	C	S	.	.	H	α-helix	trans	-53.9	-50.4	170	-80.5	0	0	0	0	110.8	L547 S595 F596 S602	L547-C599 HydrophobicContact CD1-CB 3.98Å; L547-C599 HydrophobicContact CD2-CB 4.19Å; S595-C599 PolarHBondContact O-N 3.49Å; S595-C599 PolarHBondContact O-SG 3.18Å; S595-C599 VanDerWaalsContact O-SG 3.39Å; F596-C599 WeakPolarHBondContact O-CB 3.41Å; F596-C599 PolarHBondContact O-N 2.93Å; C599-S602 PolarHBondContact O-OG 2.79Å
600	Q	94	Very high	94.8	Very high	45 Å²	45	55.6 Å²	55.6	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-69.5	-44.5	-177.8	-60.5	-72.3	45.8	0	0	112.5	D544 L547 F596 S597 L598 S602 R603	D544-Q600 PolarHBondContact OD2-NE2 3.09Å; L547-Q600 HydrophobicContact CD1-CG 4.14Å; F596-Q600 HydrophobicContact CE1-CG 4.17Å; F596-Q600 PolarHBondContact O-N 3.09Å; S597-Q600 PolarHBondContact O-N 3.14Å; L598-Q600 VanDerWaalsContact C-N 3.33Å; L598-Q600 PolarHBondContact O-N 3.35Å; Q600-S602 PolarHBondContact O-N 3.05Å; Q600-R603 WeakPolarHBondContact O-CB 3.44Å; Q600-R603 PolarHBondContact O-N 2.87Å
601	L	94.7	Very high	94.9	Very high	29 Å²	29	55.6 Å²	55.6	15%	0.152	28%	0.276	C	S	.	.	H	α-helix	trans	-58.3	-37	177.9	-179.5	60	0	0	0	112	A590 L593 S597 R603 V604 M608	A590-L601 HydrophobicContact CB-CD2 4.27Å; L593-L601 HydrophobicContact CD1-CD2 3.58Å; S597-L601 WeakPolarHBondContact O-CB 3.25Å; S597-L601 PolarHBondContact O-N 2.88Å; L601-R603 PolarHBondContact O-N 2.93Å; L601-R603 VanDerWaalsContact O-N 3.12Å; L601-V604 HydrophobicContact CD1-CG2 4.46Å; L601-V604 PolarHBondContact O-N 3.07Å; L601-V604 VanDerWaalsContact O-N 3.12Å; L601-M608 HydrophobicContact CD1-CB 3.91Å; L601-M608 HydrophobicContact CD1-CG 3.81Å; L601-M608 HydrophobicContact CD1-SD 4.03Å; L601-M608 HydrophobicContact CG-CB 4.06Å; L601-M608 HydrophobicContact CG-CG 4.45Å; L601-M608 VanDerWaalsContact O-CB 3.31Å; L601-M608 WeakPolarHBondContact O-CB 3.25Å
602	S	95.1	Very high	95	Very high	29 Å²	29	54.3 Å²	54.3	20%	0.203	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-14.8	177.8	80.2	0	0	0	0	114.9	L598 C599 Q600 R609	L598-S602 WeakPolarHBondContact O-CB 3.5Å; L598-S602 PolarHBondContact O-N 3.21Å; C599-S602 PolarHBondContact O-OG 2.79Å; Q600-S602 PolarHBondContact O-N 3.05Å; S602-R609 WeakPolarHBondContact O-CB 3.41Å; S602-R609 PolarHBondContact O-NE 3.42Å; S602-R609 VanDerWaalsContact O-NE 3.15Å
603	R	92.3	Very high	95.1	Very high	123 Å²	123	48.6 Å²	48.6	46%	0.464	25%	0.247	S	C	.	.	H	α-helix	trans	-90.7	-22.1	177.5	-60.9	170.4	69.3	-167.3	4.3	112.6	Q600 L601	Q600-R603 WeakPolarHBondContact O-CB 3.44Å; Q600-R603 PolarHBondContact O-N 2.87Å; L601-R603 PolarHBondContact O-N 2.93Å; L601-R603 VanDerWaalsContact O-N 3.12Å
604	V	92	Very high	95.1	Very high	110 Å²	110	48.3 Å²	48.3	67%	0.667	25%	0.249	S	C	*	.	H	α-helix	trans	-66.3	-44.7	-172.4	179.9	0	0	0	0	112.5	L601	L601-V604 HydrophobicContact CD1-CG2 4.46Å; L601-V604 PolarHBondContact O-N 3.07Å; L601-V604 VanDerWaalsContact O-N 3.12Å
605	S	93.9	Very high	95.2	Very high	32 Å²	32	47.1 Å²	47.1	22%	0.224	24%	0.243	C	C	.	.			trans	-155.9	167.2	177.9	79.6	0	0	0	0	112.4	T607 M608 R609	S605-T607 VanDerWaalsContact C-N 3.3Å; S605-T607 PolarHBondContact O-N 2.74Å; S605-T607 PolarHBondContact OG-N 3.29Å; S605-M608 PolarHBondContact O-N 3.25Å; S605-M608 WeakPolarHBondContact OG-CG 3.29Å; S605-M608 PolarHBondContact OG-N 3.43Å; S605-M608 VanDerWaalsContact OG-N 3.13Å; S605-R609 WeakPolarHBondContact O-CB 3.4Å; S605-R609 PolarHBondContact O-N 3.03Å
606	R	93.6	Very high	95.1	Very high	208 Å²	208	47.3 Å²	47.3	79%	0.785	24%	0.243	S	C	*	.	H	α-helix	trans	-61.4	-39.5	173.7	-63.1	-176.5	-173.9	-179.2	2.3	111.5	R609 N610	R606-R609 WeakPolarHBondContact O-CB 3.13Å; R606-R609 PolarHBondContact O-N 2.85Å; R606-N610 PolarHBondContact O-N 2.84Å; R606-N610 VanDerWaalsContact O-N 3.08Å; R606-N610 PolarHBondContact O-OD1 2.91Å
607	T	94.6	Very high	94.9	Very high	66 Å²	66	52.6 Å²	52.6	41%	0.405	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-50.5	176.3	-50.6	0	0	0	0	111	L586 S605 R609 N610 V611	L586-T607 HydrophobicContact CD1-CG2 4.37Å; S605-T607 VanDerWaalsContact C-N 3.3Å; S605-T607 PolarHBondContact O-N 2.74Å; S605-T607 PolarHBondContact OG-N 3.29Å; T607-R609 VanDerWaalsContact C-N 3.29Å; T607-R609 PolarHBondContact O-N 3.48Å; T607-N610 PolarHBondContact O-N 2.96Å; T607-N610 VanDerWaalsContact O-N 3.1Å; T607-V611 WeakPolarHBondContact O-CG2 3.42Å; T607-V611 PolarHBondContact O-N 2.83Å
608	M	95.9	Very high	94.6	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-32.3	179.9	-64.1	-54.8	154.5	0	0	112.4	F578 S579 L586 L601 S605 V611 C612	F578-M608 HydrophobicContact CD1-CE 3.58Å; F578-M608 HydrophobicContact CD1-SD 4.47Å; F578-M608 HydrophobicContact CE1-CE 3.51Å; F578-M608 HydrophobicContact CE1-SD 3.84Å; S579-M608 WeakPolarHBondContact OG-CE 3.15Å; L586-M608 HydrophobicContact CD1-CE 3.75Å; L586-M608 HydrophobicContact CD1-SD 4.41Å; L586-M608 HydrophobicContact CD2-CE 3.84Å; L586-M608 HydrophobicContact CD2-SD 4.36Å; L586-M608 HydrophobicContact CG-CE 4.42Å; L601-M608 HydrophobicContact CD1-CB 3.91Å; L601-M608 HydrophobicContact CD1-CG 3.81Å; L601-M608 HydrophobicContact CD1-SD 4.03Å; L601-M608 HydrophobicContact CG-CB 4.06Å; L601-M608 HydrophobicContact CG-CG 4.45Å; L601-M608 VanDerWaalsContact O-CB 3.31Å; L601-M608 WeakPolarHBondContact O-CB 3.25Å; S605-M608 PolarHBondContact O-N 3.25Å; S605-M608 WeakPolarHBondContact OG-CG 3.29Å; S605-M608 PolarHBondContact OG-N 3.43Å; S605-M608 VanDerWaalsContact OG-N 3.13Å; M608-V611 PolarHBondContact O-N 3.48Å; M608-C612 WeakPolarHBondContact O-CB 3.48Å; M608-C612 PolarHBondContact O-N 3.48Å; M608-C612 PolarHBondContact O-SG 3.35Å; M608-C612 VanDerWaalsContact O-SG 3.32Å
609	R	95.9	Very high	94.4	Very high	78 Å²	78	61.8 Å²	61.8	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-44.5	170.4	-165	176.7	-57.2	152.6	6.1	112.5	S602 S605 R606 T607 C612 A613	S602-R609 WeakPolarHBondContact O-CB 3.41Å; S602-R609 PolarHBondContact O-NE 3.42Å; S602-R609 VanDerWaalsContact O-NE 3.15Å; S605-R609 WeakPolarHBondContact O-CB 3.4Å; S605-R609 PolarHBondContact O-N 3.03Å; R606-R609 WeakPolarHBondContact O-CB 3.13Å; R606-R609 PolarHBondContact O-N 2.85Å; T607-R609 VanDerWaalsContact C-N 3.29Å; T607-R609 PolarHBondContact O-N 3.48Å; R609-C612 PolarHBondContact O-N 2.91Å; R609-A613 VanDerWaalsContact O-CB 3.26Å; R609-A613 WeakPolarHBondContact O-CB 3.37Å; R609-A613 PolarHBondContact O-N 3.15Å
610	N	96.3	Very high	94.4	Very high	103 Å²	103	60.9 Å²	60.9	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-66.6	-40.5	177.9	-66.9	-10.1	0	0	0	111.6	F583 R606 T607 A613 S614	F583-N610 HydrophobicContact CE2-CB 4.45Å; R606-N610 PolarHBondContact O-N 2.84Å; R606-N610 VanDerWaalsContact O-N 3.08Å; R606-N610 PolarHBondContact O-OD1 2.91Å; T607-N610 PolarHBondContact O-N 2.96Å; T607-N610 VanDerWaalsContact O-N 3.1Å; N610-A613 PolarHBondContact O-N 3.25Å; N610-S614 PolarHBondContact O-N 2.99Å; N610-S614 VanDerWaalsContact O-N 3.08Å
611	V	97.3	Very high	94.5	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-52.2	173.2	172.6	0	0	0	0	110.4	F583 L586 Q587 A590 T607 M608 A613 S614	F583-V611 HydrophobicContact CD2-CG2 3.71Å; F583-V611 HydrophobicContact CE2-CB 4.23Å; F583-V611 HydrophobicContact CE2-CG2 3.52Å; F583-V611 HydrophobicContact CZ-CG2 4.31Å; L586-V611 HydrophobicContact CB-CG1 4.07Å; L586-V611 HydrophobicContact CB-CG2 3.8Å; L586-V611 HydrophobicContact CD1-CG2 4.26Å; Q587-V611 HydrophobicContact CB-CG1 4.4Å; A590-V611 HydrophobicContact CB-CG1 3.8Å; T607-V611 WeakPolarHBondContact O-CG2 3.42Å; T607-V611 PolarHBondContact O-N 2.83Å; M608-V611 PolarHBondContact O-N 3.48Å; V611-A613 PolarHBondContact O-N 3.21Å; V611-S614 PolarHBondContact O-N 3.29Å; V611-S614 PolarHBondContact O-OG 3.16Å
612	C	97.3	Very high	94.6	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-42.7	175.7	-69.9	0	0	0	0	112	M608 R609 S614 L615 F647	M608-C612 WeakPolarHBondContact O-CB 3.48Å; M608-C612 PolarHBondContact O-N 3.48Å; M608-C612 PolarHBondContact O-SG 3.35Å; M608-C612 VanDerWaalsContact O-SG 3.32Å; R609-C612 PolarHBondContact O-N 2.91Å; C612-S614 VanDerWaalsContact C-N 3.26Å; C612-S614 PolarHBondContact O-N 3.39Å; C612-L615 WeakPolarHBondContact O-CB 3.43Å; C612-L615 PolarHBondContact O-N 3.44Å; C612-F647 HydrophobicContact CB-CE2 4.04Å; C612-F647 VanDerWaalsContact O-CZ 3.29Å; C612-F647 WeakPolarHBondContact O-CZ 3.47Å
613	A	96.1	Very high	94.5	Very high	29 Å²	29	57 Å²	57	24%	0.24	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-36.5	-180	0	0	0	0	0	112.6	R609 N610 V611 L615 L616	R609-A613 VanDerWaalsContact O-CB 3.26Å; R609-A613 WeakPolarHBondContact O-CB 3.37Å; R609-A613 PolarHBondContact O-N 3.15Å; N610-A613 PolarHBondContact O-N 3.25Å; V611-A613 PolarHBondContact O-N 3.21Å; A613-L615 PolarHBondContact O-N 2.89Å; A613-L615 VanDerWaalsContact O-N 3.15Å; A613-L616 HydrophobicContact CB-CD1 4.28Å; A613-L616 WeakPolarHBondContact O-CB 3.47Å; A613-L616 PolarHBondContact O-N 2.97Å; A613-L616 VanDerWaalsContact O-N 3.11Å
614	S	96	Very high	94.6	Very high	47 Å²	47	52.8 Å²	52.8	33%	0.329	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-21.5	175.3	79.4	0	0	0	0	114.2	Q587 N610 V611 C612	Q587-S614 WeakPolarHBondContact CG-OG 3.26Å; Q587-S614 PolarHBondContact NE2-OG 3.22Å; N610-S614 PolarHBondContact O-N 2.99Å; N610-S614 VanDerWaalsContact O-N 3.08Å; V611-S614 PolarHBondContact O-N 3.29Å; V611-S614 PolarHBondContact O-OG 3.16Å; C612-S614 VanDerWaalsContact C-N 3.26Å; C612-S614 PolarHBondContact O-N 3.39Å
615	L	96.1	Very high	94.6	Very high	17 Å²	17	49.8 Å²	49.8	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-94.2	-8.9	179.6	-59.7	177.9	0	0	0	113.1	Q587 A590 L598 C612 A613 Q617 M618 R619 F647	Q587-L615 HydrophobicContact CG-CD2 3.9Å; Q587-L615 HydrophobicContact CG-CG 4.41Å; A590-L615 HydrophobicContact CB-CD1 3.71Å; L598-L615 HydrophobicContact CD2-CD1 4.18Å; C612-L615 WeakPolarHBondContact O-CB 3.43Å; C612-L615 PolarHBondContact O-N 3.44Å; A613-L615 PolarHBondContact O-N 2.89Å; A613-L615 VanDerWaalsContact O-N 3.15Å; L615-Q617 PolarHBondContact O-N 3.47Å; L615-M618 PolarHBondContact O-N 2.93Å; L615-R619 PolarHBondContact O-N 3.01Å; L615-F647 HydrophobicContact CB-CZ 4.26Å
616	L	93.8	Very high	94.5	Very high	12 Å²	12	54.9 Å²	54.9	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-41.3	-173.7	-80.8	170.1	0	0	0	113.4	A613 M618 G620 W645 F647	A613-L616 HydrophobicContact CB-CD1 4.28Å; A613-L616 WeakPolarHBondContact O-CB 3.47Å; A613-L616 PolarHBondContact O-N 2.97Å; A613-L616 VanDerWaalsContact O-N 3.11Å; L616-M618 PolarHBondContact O-N 3.22Å; L616-G620 WeakPolarHBondContact O-CA 3.36Å; L616-G620 PolarHBondContact O-N 3.36Å; L616-W645 HydrophobicContact CB-CB 4.46Å; L616-W645 HydrophobicContact CB-CE3 4.44Å; L616-W645 HydrophobicContact CD1-CB 4.2Å; L616-W645 VanDerWaalsContact O-CZ3 3.28Å; L616-W645 WeakPolarHBondContact O-CZ3 3.29Å; L616-F647 HydrophobicContact CD2-CD1 4.22Å; L616-F647 HydrophobicContact CD2-CD2 3.75Å; L616-F647 HydrophobicContact CD2-CE1 3.96Å; L616-F647 HydrophobicContact CD2-CE2 3.45Å; L616-F647 VanDerWaalsContact CD2-CE2 3.45Å; L616-F647 HydrophobicContact CD2-CG 4.11Å; L616-F647 HydrophobicContact CD2-CZ 3.57Å; L616-F647 HydrophobicContact CG-CE2 3.9Å; L616-F647 HydrophobicContact CG-CZ 3.83Å
617	Q	90.4	Very high	94.4	Very high	117 Å²	117	48.7 Å²	48.7	55%	0.547	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-29.2	-179	-68.5	-171.2	1.7	0	0	113.4	L615 W645	L615-Q617 PolarHBondContact O-N 3.47Å; Q617-W645 HydrophobicContact CB-CH2 4.44Å; Q617-W645 HydrophobicContact CG-CH2 4.42Å; Q617-W645 HydrophobicContact CG-CZ2 4.46Å
618	M	89.4	Confident	94.2	Very high	130 Å²	130	52 Å²	52	64%	0.64	25%	0.247	S	C	*	.	H	α-helix	trans	-93.4	-38.3	-177.4	-64	-58.9	-64.8	0	0	112.5	F67 R491 L615 L616	F67-M618 HydrophobicContact CZ-SD 4.12Å; R491-M618 PolarHBondContact NH1-O 2.81Å; L615-M618 PolarHBondContact O-N 2.93Å; L616-M618 PolarHBondContact O-N 3.22Å
619	R	92.4	Very high	93.9	Very high	99 Å²	99	56.1 Å²	56.1	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-116	-25.2	-172.1	-69.7	-165.3	171.6	-156	0.2	115.1	R491 S591 L593 L615 F647	R491-R619 WeakPolarHBondContact CD-O 3.44Å; R491-R619 PolarHBondContact NH1-O 3.47Å; S591-R619 PolarHBondContact O-NH1 2.84Å; S591-R619 PolarHBondContact O-NH2 3.43Å; L593-R619 PolarHBondContact O-NH1 3.19Å; L615-R619 PolarHBondContact O-N 3.01Å; R619-F647 HydrophobicContact CB-CD1 4.48Å; R619-F647 HydrophobicContact CB-CE1 3.95Å
620	G	94.6	Very high	93.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.288	C	S	.	.			trans	-73.9	-172.9	175	0	0	0	0	0	113.3	P82 R491 L616 R646	P82-G620 WeakPolarHBondContact CB-O 3.48Å; R491-G620 PolarHBondContact NH1-O 3.43Å; L616-G620 WeakPolarHBondContact O-CA 3.36Å; L616-G620 PolarHBondContact O-N 3.36Å; G620-R646 CarbonylContact C-O 3.59Å; G620-R646 WeakPolarHBondContact CA-O 3.4Å
621	M	96.4	Very high	92.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.7	178.3	66.2	177.8	178.8	0	0	111	P82 I85 L489 R491 V623 W645 R646	P82-M621 CarbonylContact O-C 3.47Å; P82-M621 WeakPolarHBondContact O-CA 3.5Å; P82-M621 WeakPolarHBondContact O-CB 2.97Å; I85-M621 HydrophobicContact CD1-CB 3.78Å; I85-M621 HydrophobicContact CD1-CG 3.89Å; I85-M621 HydrophobicContact CD1-SD 3.83Å; I85-M621 HydrophobicContact CG1-CB 4.08Å; I85-M621 HydrophobicContact CG1-SD 4.28Å; L489-M621 HydrophobicContact CB-CE 4.07Å; L489-M621 HydrophobicContact CB-SD 4.38Å; L489-M621 WeakPolarHBondContact O-CE 3.45Å; R491-M621 HydrophobicContact CG-CB 3.78Å; M621-V623 HydrophobicContact CE-CG2 3.98Å; M621-V623 HydrophobicContact CG-CG2 4.35Å; M621-V623 HydrophobicContact SD-CG2 4.35Å; M621-W645 WeakPolarHBondContact O-CA 3.36Å; M621-R646 HydrophobicContact CE-CG 3.99Å; M621-R646 WeakPolarHBondContact CG-O 3.4Å; M621-R646 PolarHBondContact N-O 3.08Å; M621-R646 PolarHBondContact O-N 3.38Å
622	V	96.4	Very high	92.3	Very high	5 Å²	5	72.3 Å²	72.3	3%	0.03	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	106.4	-179	-168	0	0	0	0	110.8	F63 P82 A83 I85 K643 W645	F63-V622 WeakPolarHBondContact O-CG1 3.4Å; P82-V622 HydrophobicContact CB-CG2 4.35Å; P82-V622 PolarHBondContact O-N 2.78Å; A83-V622 HydrophobicContact CB-CB 4.38Å; I85-V622 WeakPolarHBondContact CD1-O 3.41Å; V622-K643 HydrophobicContact CG1-CB 3.85Å; V622-W645 HydrophobicContact CG2-CD2 3.65Å; V622-W645 VanDerWaalsContact CG2-CE2 3.44Å; V622-W645 HydrophobicContact CG2-CE3 3.75Å; V622-W645 HydrophobicContact CG2-CG 4.44Å; V622-W645 HydrophobicContact CG2-CH2 3.54Å; V622-W645 HydrophobicContact CG2-CZ2 3.41Å; V622-W645 VanDerWaalsContact CG2-CZ2 3.41Å; V622-W645 HydrophobicContact CG2-CZ3 3.7Å
623	V	94.7	Very high	91.7	Very high	17 Å²	17	77.8 Å²	77.8	10%	0.103	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.7	178.1	176.9	0	0	0	0	110.1	I85 L489 M621 V644 R646	I85-V623 HydrophobicContact CD1-CG2 3.63Å; L489-V623 HydrophobicContact CD1-CG1 3.84Å; L489-V623 HydrophobicContact CD1-CG2 3.89Å; M621-V623 HydrophobicContact CE-CG2 3.98Å; M621-V623 HydrophobicContact CG-CG2 4.35Å; M621-V623 HydrophobicContact SD-CG2 4.35Å; V623-V644 PolarHBondContact N-O 3Å; V623-V644 PolarHBondContact O-N 3.11Å; V623-R646 HydrophobicContact CG2-CG 4.42Å
624	L	93.6	Very high	91.3	Very high	35 Å²	35	78.2 Å²	78.2	18%	0.183	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.8	175.8	-49.5	175	0	0	0	109.1	F63 I640 K643	F63-L624 HydrophobicContact CD1-CD1 3.72Å; F63-L624 HydrophobicContact CE1-CD1 4.24Å; L624-I640 HydrophobicContact CB-CG1 4.4Å; L624-I640 HydrophobicContact CB-CG2 4.21Å; L624-I640 HydrophobicContact CD1-CD1 3.87Å; L624-I640 HydrophobicContact CD1-CG1 4.41Å; L624-I640 HydrophobicContact CD2-CG2 4.33Å; L624-K643 HydrophobicContact CD2-CG 3.99Å
625	L	92.2	Very high	90.9	Very high	46 Å²	46	78.1 Å²	78.1	24%	0.241	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134	167.9	-61.1	-170.4	0	0	0	109.7	E272 I640 T641 H642 V644	E272-L625 VanDerWaalsContact OE1-CD1 3.25Å; E272-L625 WeakPolarHBondContact OE1-CD1 3.39Å; L625-I640 VanDerWaalsContact O-CA 3.29Å; L625-I640 WeakPolarHBondContact O-CA 3.19Å; L625-T641 PolarHBondContact O-N 3.39Å; L625-H642 HydrophobicContact CB-CB 4.29Å; L625-H642 HydrophobicContact CD1-CB 4.12Å; L625-H642 HydrophobicContact CG-CB 4.38Å; L625-H642 PolarHBondContact N-O 3.11Å; L625-V644 HydrophobicContact CD1-CG2 3.65Å; L625-V644 HydrophobicContact CG-CG2 3.86Å
626	W	91.6	Very high	90.6	Very high	140 Å²	140	81.4 Å²	81.4	53%	0.53	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	-178.8	-68.4	85.3	0	0	0	109.6	W638 Q639 I640	W626-W638 HydrophobicContact CB-CE3 4.07Å; W626-W638 HydrophobicContact CE3-CB 4.03Å; W626-W638 WeakPolarHBondContact O-CZ3 3.49Å; W626-Q639 WeakPolarHBondContact CA-O 3.34Å; W626-I640 HydrophobicContact CD2-CG1 3.9Å; W626-I640 HydrophobicContact CE3-CG1 3.96Å; W626-I640 HydrophobicContact CH2-CD1 3.92Å; W626-I640 HydrophobicContact CH2-CG1 3.63Å; W626-I640 HydrophobicContact CZ2-CD1 3.82Å; W626-I640 HydrophobicContact CZ2-CG1 3.54Å; W626-I640 HydrophobicContact CZ3-CG1 3.84Å
627	E	91.3	Very high	90.5	Very high	78 Å²	78	81.4 Å²	81.4	36%	0.364	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.7	174	-69.3	162.1	-134.5	0	0	111	K629 W638 Q639 T641 H642	E627-K629 PolarHBondContact O-N 3.46Å; E627-W638 VanDerWaalsContact C-CE3 3.44Å; E627-W638 WeakPolarHBondContact O-CA 3.48Å; E627-Q639 PolarHBondContact N-O 2.74Å; E627-Q639 PolarHBondContact O-N 2.79Å; E627-T641 HydrophobicContact CB-CG2 3.7Å; E627-T641 VanDerWaalsContact CD-CG2 3.41Å; E627-T641 HydrophobicContact CG-CG2 3.91Å; E627-T641 WeakPolarHBondContact OE1-CB 3.19Å; E627-T641 WeakPolarHBondContact OE1-CG2 3.43Å; E627-T641 PolarHBondContact OE1-OG1 2.82Å; E627-H642 IonicContact OE1-CD2 3.12Å
628	K	90.6	Very high	90.5	Very high	136 Å²	136	83.6 Å²	83.6	59%	0.591	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	88.3	179.8	-170.3	175.6	180	179.5	0	109.8	P636 S637 W638	K628-P636 HydrophobicContact CD-CB 4.34Å; K628-P636 VanDerWaalsContact CE-CB 3.44Å; K628-P636 HydrophobicContact CG-CB 4.02Å; K628-S637 CarbonylContact C-O 3.59Å; K628-S637 WeakPolarHBondContact CA-O 3.5Å; K628-W638 HydrophobicContact CB-CD2 4.25Å; K628-W638 HydrophobicContact CB-CE3 4.13Å; K628-W638 HydrophobicContact CB-CH2 4.23Å; K628-W638 HydrophobicContact CB-CZ2 4.34Å; K628-W638 HydrophobicContact CB-CZ3 4.12Å; K628-W638 HydrophobicContact CD-CZ2 4.46Å
629	K	89.2	Confident	90.6	Very high	87 Å²	87	80.9 Å²	80.9	38%	0.378	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	142.9	177.7	-69.2	-175.4	172.4	175.7	0	111.2	E627 S637 T641	E627-K629 PolarHBondContact O-N 3.46Å; K629-S637 PolarHBondContact N-O 2.88Å; K629-S637 PolarHBondContact O-N 2.83Å; K629-S637 PolarHBondContact O-OG 3.24Å; K629-T641 HydrophobicContact CD-CG2 4.19Å; K629-T641 VanDerWaalsContact CE-CG2 3.46Å; K629-T641 VanDerWaalsContact NZ-CG2 3.33Å
630	R	89.4	Confident	90.5	Very high	209 Å²	209	79.7 Å²	79.7	79%	0.789	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	138.1	169.4	-67.5	-170.9	-176.3	-140	5.9	109.3	S635	R630-S635 CarbonylContact C-O 3.59Å; R630-S635 WeakPolarHBondContact CA-O 3.29Å
631	R	83.1	Confident	90.2	Very high	135 Å²	135	81.1 Å²	81.1	51%	0.509	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-83.1	172	169.6	-67.1	-179.1	175.5	-163.2	-1.8	110.3	D633 G634 S635 S637	R631-D633 VanDerWaalsContact CB-OD1 3.28Å; R631-D633 WeakPolarHBondContact CB-OD1 3.15Å; R631-D633 PolarHBondContact O-N 2.92Å; R631-G634 WeakPolarHBondContact O-CA 3.36Å; R631-G634 PolarHBondContact O-N 3.1Å; R631-S635 PolarHBondContact N-O 2.6Å; R631-S637 WeakPolarHBondContact CG-OG 3.38Å; R631-S637 PolarHBondContact NE-OG 2.76Å
632	D	84.1	Confident	90	Very high	179 Å²	179	85 Å²	85	96%	0.957	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	178.4	-48.1	-48.9	0	0	0	112.9	G634	D632-G634 PolarHBondContact O-N 2.99Å
633	D	85.1	Confident	89.9	Confident	116 Å²	116	89.5 Å²	89.5	62%	0.62	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	3.4	171.9	64.6	16	0	0	0	113.8	R631 S635	R631-D633 VanDerWaalsContact CB-OD1 3.28Å; R631-D633 WeakPolarHBondContact CB-OD1 3.15Å; R631-D633 PolarHBondContact O-N 2.92Å; D633-S635 PolarHBondContact O-N 3.04Å; D633-S635 WeakPolarHBondContact OD1-CA 3.35Å; D633-S635 WeakPolarHBondContact OD1-CB 3.33Å; D633-S635 PolarHBondContact OD1-N 3.27Å; D633-S635 PolarHBondContact OD1-OG 3.44Å; D633-S635 PolarHBondContact OD2-OG 2.89Å
634	G	86.3	Confident	89.9	Confident	38 Å²	38	89.3 Å²	89.3	39%	0.392	43%	0.425	S	S	.	.	S	Bend	trans	78.6	-8.2	-176.9	0	0	0	0	0	115.2	R631 D632	R631-G634 WeakPolarHBondContact O-CA 3.36Å; R631-G634 PolarHBondContact O-N 3.1Å; D632-G634 PolarHBondContact O-N 2.99Å
635	S	87.9	Confident	90	Very high	45 Å²	45	89.8 Å²	89.8	32%	0.315	42%	0.424	S	S	.	.			trans	-72.4	141.8	-178.6	73.5	0	0	0	0	111.9	R630 R631 D633	R630-S635 CarbonylContact C-O 3.59Å; R630-S635 WeakPolarHBondContact CA-O 3.29Å; R631-S635 PolarHBondContact N-O 2.6Å; D633-S635 PolarHBondContact O-N 3.04Å; D633-S635 WeakPolarHBondContact OD1-CA 3.35Å; D633-S635 WeakPolarHBondContact OD1-CB 3.33Å; D633-S635 PolarHBondContact OD1-N 3.27Å; D633-S635 PolarHBondContact OD1-OG 3.44Å; D633-S635 PolarHBondContact OD2-OG 2.89Å
636	P	89.8	Confident	90.1	Very high	85 Å²	85	91.4 Å²	91.4	55%	0.552	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.9	175.9	30.7	-32.5	0	0	0	111.2	K628	K628-P636 HydrophobicContact CD-CB 4.34Å; K628-P636 VanDerWaalsContact CE-CB 3.44Å; K628-P636 HydrophobicContact CG-CB 4.02Å
637	S	91.3	Very high	90.4	Very high	13 Å²	13	85.3 Å²	85.3	9%	0.091	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.3	174.9	68.6	0	0	0	0	112	K628 K629 R631 Q639	K628-S637 CarbonylContact C-O 3.59Å; K628-S637 WeakPolarHBondContact CA-O 3.5Å; K629-S637 PolarHBondContact N-O 2.88Å; K629-S637 PolarHBondContact O-N 2.83Å; K629-S637 PolarHBondContact O-OG 3.24Å; R631-S637 WeakPolarHBondContact CG-OG 3.38Å; R631-S637 PolarHBondContact NE-OG 2.76Å; S637-Q639 PolarHBondContact OG-NE2 3.14Å; S637-Q639 VanDerWaalsContact OG-NE2 3.1Å
638	W	91.9	Very high	90.6	Very high	162 Å²	162	81.7 Å²	81.7	61%	0.614	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	127.2	169.2	-69.2	104	0	0	0	109.5	W626 E627 K628	W626-W638 HydrophobicContact CB-CE3 4.07Å; W626-W638 HydrophobicContact CE3-CB 4.03Å; W626-W638 WeakPolarHBondContact O-CZ3 3.49Å; E627-W638 VanDerWaalsContact C-CE3 3.44Å; E627-W638 WeakPolarHBondContact O-CA 3.48Å; K628-W638 HydrophobicContact CB-CD2 4.25Å; K628-W638 HydrophobicContact CB-CE3 4.13Å; K628-W638 HydrophobicContact CB-CH2 4.23Å; K628-W638 HydrophobicContact CB-CZ2 4.34Å; K628-W638 HydrophobicContact CB-CZ3 4.12Å; K628-W638 HydrophobicContact CD-CZ2 4.46Å
639	Q	90.6	Very high	90.8	Very high	73 Å²	73	75.8 Å²	75.8	34%	0.341	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146.2	178.4	-61.5	-177.3	8.8	0	0	109.3	W626 E627 S637 T641	W626-Q639 WeakPolarHBondContact CA-O 3.34Å; E627-Q639 PolarHBondContact N-O 2.74Å; E627-Q639 PolarHBondContact O-N 2.79Å; S637-Q639 PolarHBondContact OG-NE2 3.14Å; S637-Q639 VanDerWaalsContact OG-NE2 3.1Å; Q639-T641 PolarHBondContact O-N 3.09Å
640	I	91	Very high	91.1	Very high	74 Å²	74	71.9 Å²	71.9	38%	0.379	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126.2	171.6	-60	161.5	0	0	0	107.5	L624 L625 W626	L624-I640 HydrophobicContact CB-CG1 4.4Å; L624-I640 HydrophobicContact CB-CG2 4.21Å; L624-I640 HydrophobicContact CD1-CD1 3.87Å; L624-I640 HydrophobicContact CD1-CG1 4.41Å; L624-I640 HydrophobicContact CD2-CG2 4.33Å; L625-I640 VanDerWaalsContact O-CA 3.29Å; L625-I640 WeakPolarHBondContact O-CA 3.19Å; W626-I640 HydrophobicContact CD2-CG1 3.9Å; W626-I640 HydrophobicContact CE3-CG1 3.96Å; W626-I640 HydrophobicContact CH2-CD1 3.92Å; W626-I640 HydrophobicContact CH2-CG1 3.63Å; W626-I640 HydrophobicContact CZ2-CD1 3.82Å; W626-I640 HydrophobicContact CZ2-CG1 3.54Å; W626-I640 HydrophobicContact CZ3-CG1 3.84Å
641	T	88.6	Confident	91.4	Very high	30 Å²	30	62.2 Å²	62.2	18%	0.184	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-45.1	-179.9	52.8	0	0	0	0	112	L625 E627 K629 Q639	L625-T641 PolarHBondContact O-N 3.39Å; E627-T641 HydrophobicContact CB-CG2 3.7Å; E627-T641 VanDerWaalsContact CD-CG2 3.41Å; E627-T641 HydrophobicContact CG-CG2 3.91Å; E627-T641 WeakPolarHBondContact OE1-CB 3.19Å; E627-T641 WeakPolarHBondContact OE1-CG2 3.43Å; E627-T641 PolarHBondContact OE1-OG1 2.82Å; K629-T641 HydrophobicContact CD-CG2 4.19Å; K629-T641 VanDerWaalsContact CE-CG2 3.46Å; K629-T641 VanDerWaalsContact NZ-CG2 3.33Å; Q639-T641 PolarHBondContact O-N 3.09Å
642	H	91.6	Very high	91.8	Very high	81 Å²	81	57.5 Å²	57.5	38%	0.375	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.3	-178.6	-57.8	-83	0	0	0	111.7	H274 L625 E627 V644	H274-H642 AromaticContact CE1-CG 3.98Å; H274-H642 AromaticContact CE1-ND1 3.95Å; H274-H642 AromaticContact ND1-ND1 3.81Å; L625-H642 HydrophobicContact CB-CB 4.29Å; L625-H642 HydrophobicContact CD1-CB 4.12Å; L625-H642 HydrophobicContact CG-CB 4.38Å; L625-H642 PolarHBondContact N-O 3.11Å; E627-H642 IonicContact OE1-CD2 3.12Å; H642-V644 HydrophobicContact CB-CG2 4.18Å
643	K	94.7	Very high	92.1	Very high	101 Å²	101	52.5 Å²	52.5	44%	0.439	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	101.2	172	-68.6	173.4	176.2	176.3	0	107.3	G62 V622 L624	G62-K643 WeakPolarHBondContact O-CE 3.01Å; G62-K643 PolarHBondContact O-NZ 2.9Å; V622-K643 HydrophobicContact CG1-CB 3.85Å; L624-K643 HydrophobicContact CD2-CG 3.99Å
644	V	93.9	Very high	92.5	Very high	12 Å²	12	47.1 Å²	47.1	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.3	-170.8	176.2	0	0	0	0	110.9	E272 V623 L625 H642	E272-V644 HydrophobicContact CG-CG1 4.29Å; E272-V644 HydrophobicContact CG-CG2 4.27Å; V623-V644 PolarHBondContact N-O 3Å; V623-V644 PolarHBondContact O-N 3.11Å; L625-V644 HydrophobicContact CD1-CG2 3.65Å; L625-V644 HydrophobicContact CG-CG2 3.86Å; H642-V644 HydrophobicContact CB-CG2 4.18Å
645	W	95.3	Very high	92.7	Very high	45 Å²	45	51.5 Å²	51.5	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	127.9	172.8	-75	90.1	0	0	0	110.8	P66 P82 L616 Q617 M621 V622	P66-W645 HydrophobicContact CG-CH2 4.17Å; P66-W645 HydrophobicContact CG-CZ2 4.04Å; P82-W645 HydrophobicContact CB-CH2 3.78Å; P82-W645 HydrophobicContact CB-CZ3 3.51Å; P82-W645 HydrophobicContact CG-CH2 3.66Å; P82-W645 HydrophobicContact CG-CZ3 3.94Å; L616-W645 HydrophobicContact CB-CB 4.46Å; L616-W645 HydrophobicContact CB-CE3 4.44Å; L616-W645 HydrophobicContact CD1-CB 4.2Å; L616-W645 VanDerWaalsContact O-CZ3 3.28Å; L616-W645 WeakPolarHBondContact O-CZ3 3.29Å; Q617-W645 HydrophobicContact CB-CH2 4.44Å; Q617-W645 HydrophobicContact CG-CH2 4.42Å; Q617-W645 HydrophobicContact CG-CZ2 4.46Å; M621-W645 WeakPolarHBondContact O-CA 3.36Å; V622-W645 HydrophobicContact CG2-CD2 3.65Å; V622-W645 VanDerWaalsContact CG2-CE2 3.44Å; V622-W645 HydrophobicContact CG2-CE3 3.75Å; V622-W645 HydrophobicContact CG2-CG 4.44Å; V622-W645 HydrophobicContact CG2-CH2 3.54Å; V622-W645 HydrophobicContact CG2-CZ2 3.41Å; V622-W645 VanDerWaalsContact CG2-CZ2 3.41Å; V622-W645 HydrophobicContact CG2-CZ3 3.7Å
646	R	95.1	Very high	92.9	Very high	81 Å²	81	54 Å²	54	31%	0.306	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	163.2	171.9	61.5	-174.8	-176	108.1	-10.2	111.8	G620 M621 V623	G620-R646 CarbonylContact C-O 3.59Å; G620-R646 WeakPolarHBondContact CA-O 3.4Å; M621-R646 HydrophobicContact CE-CG 3.99Å; M621-R646 WeakPolarHBondContact CG-O 3.4Å; M621-R646 PolarHBondContact N-O 3.08Å; M621-R646 PolarHBondContact O-N 3.38Å; V623-R646 HydrophobicContact CG2-CG 4.42Å
647	F	96.7	Very high	93.1	Very high	12 Å²	12	52.8 Å²	52.8	5%	0.053	26%	0.257	C	S	.	.			trans	-76	156.8	164.8	-60.9	-71.7	0	0	0	110.3	L598 C612 L615 L616 R619	L598-F647 HydrophobicContact CB-CD1 4.24Å; L598-F647 HydrophobicContact CB-CD2 3.91Å; L598-F647 HydrophobicContact CB-CE1 4.35Å; L598-F647 HydrophobicContact CB-CE2 4.03Å; L598-F647 HydrophobicContact CB-CG 4.02Å; L598-F647 HydrophobicContact CB-CZ 4.25Å; L598-F647 HydrophobicContact CD1-CD1 3.97Å; L598-F647 HydrophobicContact CD1-CE1 3.67Å; L598-F647 HydrophobicContact CD1-CZ 4.03Å; C612-F647 HydrophobicContact CB-CE2 4.04Å; C612-F647 VanDerWaalsContact O-CZ 3.29Å; C612-F647 WeakPolarHBondContact O-CZ 3.47Å; L615-F647 HydrophobicContact CB-CZ 4.26Å; L616-F647 HydrophobicContact CD2-CD1 4.22Å; L616-F647 HydrophobicContact CD2-CD2 3.75Å; L616-F647 HydrophobicContact CD2-CE1 3.96Å; L616-F647 HydrophobicContact CD2-CE2 3.45Å; L616-F647 VanDerWaalsContact CD2-CE2 3.45Å; L616-F647 HydrophobicContact CD2-CG 4.11Å; L616-F647 HydrophobicContact CD2-CZ 3.57Å; L616-F647 HydrophobicContact CG-CE2 3.9Å; L616-F647 HydrophobicContact CG-CZ 3.83Å; R619-F647 HydrophobicContact CB-CD1 4.48Å; R619-F647 HydrophobicContact CB-CE1 3.95Å
648	S	95.9	Very high	93.1	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	27%	0.268	C	S	.	.			trans	-78.9	171	169.5	73.7	0	0	0	0	110.8	E494 S595 A650	E494-S648 PolarHBondContact OE1-OG 3.29Å; E494-S648 WeakPolarHBondContact OE2-CB 3.35Å; E494-S648 PolarHBondContact OE2-OG 3.2Å; S595-S648 CarbonylContact C-O 3.5Å; S595-S648 WeakPolarHBondContact CB-O 3.48Å; S595-S648 WeakPolarHBondContact CB-OG 3.38Å; S648-A650 PolarHBondContact O-N 3.34Å; S648-A650 WeakPolarHBondContact OG-CB 3.28Å; S648-A650 PolarHBondContact OG-N 2.92Å
649	T	95.5	Very high	93	Very high	13 Å²	13	54 Å²	54	8%	0.08	27%	0.265	C	S	.	.	S	Bend	trans	-86.8	12.6	174.1	53.1	0	0	0	0	112.8	Q488 L547 S549	Q488-T649 VanDerWaalsContact CD-OG1 3.23Å; Q488-T649 PolarHBondContact NE2-OG1 2.73Å; Q488-T649 PolarHBondContact OE1-OG1 3.44Å; L547-T649 HydrophobicContact CB-CG2 4.25Å; S549-T649 PolarHBondContact OG-O 2.86Å
650	A	95.6	Very high	92.9	Very high	5 Å²	5	51.6 Å²	51.6	4%	0.041	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-78.7	130.6	-178.6	0	0	0	0	0	111.5	F490 E494 F596 S648	F490-A650 HydrophobicContact CD1-CB 3.75Å; F490-A650 HydrophobicContact CE1-CB 3.78Å; E494-A650 HydrophobicContact CB-CB 4.15Å; F596-A650 WeakPolarHBondContact CB-O 3.42Å; F596-A650 PolarHBondContact N-O 3.43Å; S648-A650 PolarHBondContact O-N 3.34Å; S648-A650 WeakPolarHBondContact OG-CB 3.28Å; S648-A650 PolarHBondContact OG-N 2.92Å
651	F	95.1	Very high	92.7	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.026	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-95.3	164.4	165.6	71.4	-88.1	0	0	0	110.9	N501 V502 I506 I541 F550 V552 D594 F596 V654	N501-F651 HydrophobicContact CB-CE1 4.13Å; N501-F651 HydrophobicContact CB-CE2 4.11Å; N501-F651 HydrophobicContact CB-CZ 3.6Å; N501-F651 WeakPolarHBondContact ND2-CE2 3.28Å; V502-F651 HydrophobicContact CG2-CE1 4.01Å; I506-F651 HydrophobicContact CD1-CE1 4.29Å; I506-F651 HydrophobicContact CD1-CZ 3.89Å; I541-F651 HydrophobicContact CD1-CE2 4.44Å; F550-F651 HydrophobicContact CB-CE1 3.9Å; F550-F651 WeakPolarHBondContact O-CD1 3.38Å; V552-F651 HydrophobicContact CB-CD2 4.5Å; V552-F651 HydrophobicContact CG2-CD2 3.45Å; V552-F651 VanDerWaalsContact CG2-CD2 3.45Å; V552-F651 HydrophobicContact CG2-CE2 3.57Å; V552-F651 HydrophobicContact CG2-CG 4.42Å; D594-F651 VanDerWaalsContact OD2-CA 3.25Å; D594-F651 WeakPolarHBondContact OD2-CA 3.31Å; F596-F651 HydrophobicContact CB-CB 3.95Å; F596-F651 HydrophobicContact CG-CB 4.36Å; F651-V654 HydrophobicContact CE2-CG2 3.74Å
652	G	91.4	Very high	92.5	Very high	36 Å²	36	57.2 Å²	57.2	37%	0.371	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-57.2	148.4	-175.3	0	0	0	0	0	114	N501 D594 V654	N501-G652 PolarHBondContact ND2-O 3.44Å; D594-G652 PolarHBondContact OD2-N 3.06Å; G652-V654 PolarHBondContact O-N 2.92Å
653	T	91.6	Very high	92.3	Very high	73 Å²	73	56.3 Å²	56.3	45%	0.448	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-57.2	123.5	180	-49.4	0	0	0	0	111.6	S497 N655	S497-T653 WeakPolarHBondContact CB-OG1 3.13Å; T653-N655 PolarHBondContact O-N 2.87Å
654	V	92.9	Very high	92	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.018	29%	0.293	C	S	.	.			trans	-81.2	111.9	171.5	-176.9	0	0	0	0	107.9	K500 N501 P534 F651 G652 E656 W657	K500-V654 PolarHBondContact NZ-O 3.46Å; N501-V654 PolarHBondContact OD1-N 3.3Å; P534-V654 HydrophobicContact CB-CB 4.45Å; P534-V654 HydrophobicContact CB-CG1 3.7Å; P534-V654 HydrophobicContact CB-CG2 3.85Å; F651-V654 HydrophobicContact CE2-CG2 3.74Å; G652-V654 PolarHBondContact O-N 2.92Å; V654-E656 VanDerWaalsContact CG1-O 3.3Å; V654-E656 WeakPolarHBondContact CG1-O 3.47Å; V654-W657 HydrophobicContact CB-CZ2 4.28Å; V654-W657 HydrophobicContact CG1-CD2 3.95Å; V654-W657 HydrophobicContact CG1-CG 4.28Å; V654-W657 HydrophobicContact CG1-CZ2 4.05Å; V654-W657 HydrophobicContact CG2-CZ2 4.2Å
655	N	90.6	Very high	91.9	Very high	130 Å²	130	54.6 Å²	54.6	70%	0.695	29%	0.293	S	S	*	.			trans	-78.8	-38.2	-179.3	-66.5	-40.5	0	0	0	111.7	T653	T653-N655 PolarHBondContact O-N 2.87Å
656	E	92.3	Very high	91.7	Very high	98 Å²	98	54.7 Å²	54.7	46%	0.458	30%	0.304	S	S	.	.			trans	-142.1	145	-174.6	-171.2	-173.5	179.1	0	0	110.3	S535 V654 K658	S535-E656 WeakPolarHBondContact CA-O 3.49Å; S535-E656 PolarHBondContact N-O 3.41Å; V654-E656 VanDerWaalsContact CG1-O 3.3Å; V654-E656 WeakPolarHBondContact CG1-O 3.47Å; E656-K658 HydrophobicContact CG-CG 4.39Å; E656-K658 WeakPolarHBondContact OE1-CE 3.48Å; E656-K658 IonicContact OE1-NZ 2.67Å; E656-K658 PolarHBondContact OE1-NZ 3.14Å; E656-K658 WeakPolarHBondContact OE2-CE 3.37Å; E656-K658 IonicContact OE2-NZ 3.68Å; E656-K658 PolarHBondContact OE2-NZ 3.21Å
657	W	92.6	Very high	91.5	Very high	60 Å²	60	54.1 Å²	54.1	23%	0.227	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.3	169.9	-67.2	96	0	0	0	109.2	D505 I506 M514 F532 P534 I541 V654	D505-W657 HydrophobicContact CB-CZ2 3.75Å; D505-W657 VanDerWaalsContact CG-NE1 3.33Å; D505-W657 PolarHBondContact OD2-NE1 3.45Å; I506-W657 HydrophobicContact CG1-CH2 4.05Å; I506-W657 HydrophobicContact CG1-CZ2 4.33Å; M514-W657 HydrophobicContact CE-CE3 4.25Å; M514-W657 HydrophobicContact CE-CH2 3.6Å; M514-W657 HydrophobicContact CE-CZ2 4.04Å; M514-W657 HydrophobicContact CE-CZ3 3.72Å; M514-W657 HydrophobicContact SD-CH2 4.37Å; M514-W657 HydrophobicContact SD-CZ3 4.39Å; F532-W657 HydrophobicContact CB-CE3 3.95Å; P534-W657 HydrophobicContact CB-CE3 4.48Å; P534-W657 HydrophobicContact CB-CZ3 4.3Å; I541-W657 HydrophobicContact CD1-CH2 3.71Å; I541-W657 HydrophobicContact CD1-CZ3 4.02Å; I541-W657 HydrophobicContact CG1-CH2 3.7Å; I541-W657 HydrophobicContact CG1-CZ3 3.74Å; V654-W657 HydrophobicContact CB-CZ2 4.28Å; V654-W657 HydrophobicContact CG1-CD2 3.95Å; V654-W657 HydrophobicContact CG1-CG 4.28Å; V654-W657 HydrophobicContact CG1-CZ2 4.05Å; V654-W657 HydrophobicContact CG2-CZ2 4.2Å
658	K	91.6	Very high	91.3	Very high	73 Å²	73	55 Å²	55	32%	0.317	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151	177.1	-68.7	-172.8	170.4	99.6	0	110.1	F532 C533 S535 E656 A660	F532-K658 CarbonylContact C-O 3.58Å; F532-K658 VanDerWaalsContact CA-O 3.24Å; F532-K658 WeakPolarHBondContact CA-O 3.41Å; C533-K658 PolarHBondContact N-O 2.59Å; C533-K658 PolarHBondContact O-N 3.37Å; C533-K658 PolarHBondContact SG-O 2.97Å; S535-K658 PolarHBondContact O-NZ 3.31Å; E656-K658 HydrophobicContact CG-CG 4.39Å; E656-K658 WeakPolarHBondContact OE1-CE 3.48Å; E656-K658 IonicContact OE1-NZ 2.67Å; E656-K658 PolarHBondContact OE1-NZ 3.14Å; E656-K658 WeakPolarHBondContact OE2-CE 3.37Å; E656-K658 IonicContact OE2-NZ 3.68Å; E656-K658 PolarHBondContact OE2-NZ 3.21Å; K658-A660 PolarHBondContact O-N 2.83Å
659	F	91.1	Very high	91.1	Very high	127 Å²	127	57 Å²	57	56%	0.557	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	128.5	167	-75.3	-71.1	0	0	0	109.1	R531 F532 Q537	R531-F659 CarbonylContact O-C 3.6Å; R531-F659 WeakPolarHBondContact O-CA 3.39Å; F532-F659 HydrophobicContact CD1-CD1 4Å; F532-F659 HydrophobicContact CD1-CE1 4.18Å; F532-F659 HydrophobicContact CD1-CG 4.46Å; F532-F659 AromaticContact CE1-CD1 3.52Å; F532-F659 HydrophobicContact CE1-CD1 3.52Å; F532-F659 HydrophobicContact CE1-CD2 4.45Å; F532-F659 AromaticContact CE1-CE1 3.26Å; F532-F659 HydrophobicContact CE1-CE1 3.26Å; F532-F659 HydrophobicContact CE1-CE2 4.25Å; F532-F659 HydrophobicContact CE1-CG 4.12Å; F532-F659 AromaticContact CE1-CZ 3.67Å; F532-F659 HydrophobicContact CE1-CZ 3.67Å; F532-F659 HydrophobicContact CZ-CD1 4.18Å; F532-F659 AromaticContact CZ-CE1 3.55Å; F532-F659 HydrophobicContact CZ-CE1 3.55Å; F532-F659 AromaticContact CZ-CZ 3.99Å; F532-F659 HydrophobicContact CZ-CZ 3.99Å; Q537-F659 PolarHBondContact NE2-O 3.49Å
660	A	87.5	Confident	90.9	Very high	22 Å²	22	63.7 Å²	63.7	18%	0.182	35%	0.349	C	S	.	.			trans	-68.1	142.9	176.8	0	0	0	0	0	110.3	R531 C533 K658 I662	R531-A660 PolarHBondContact O-N 3.46Å; C533-A660 HydrophobicContact CB-CB 4.41Å; K658-A660 PolarHBondContact O-N 2.83Å; A660-I662 HydrophobicContact CB-CG2 3.87Å; A660-I662 PolarHBondContact O-N 3.46Å
661	D	87.5	Confident	90.7	Very high	149 Å²	149	72.2 Å²	72.2	80%	0.797	39%	0.385	S	S	*	.			trans	-76.3	88.2	172.7	-169.1	16.5	0	0	0	109.9
662	I	84.9	Confident	90.5	Very high	74 Å²	74	72.5 Å²	72.5	38%	0.379	39%	0.388	S	S	.	.			trans	-133.6	155.4	-173.8	62.4	179.8	0	0	0	111.2	Q529 R530 R531 A660	Q529-I662 HydrophobicContact CB-CD1 4.11Å; Q529-I662 HydrophobicContact CG-CD1 4.08Å; R530-I662 WeakPolarHBondContact O-CD1 3.21Å; R531-I662 HydrophobicContact CG-CD1 4.38Å; A660-I662 HydrophobicContact CB-CG2 3.87Å; A660-I662 PolarHBondContact O-N 3.46Å
663	A	86.4	Confident	90.5	Very high	61 Å²	61	80.2 Å²	80.2	50%	0.504	41%	0.411	S	S	.	.			trans	-58.5	152.2	174.3	0	0	0	0	0	112.1	Q529	Q529-A663 PolarHBondContact NE2-O 3.46Å
664	S	89	Confident	90.3	Very high	64 Å²	64	80.5 Å²	80.5	45%	0.448	41%	0.406	S	S	.	.			trans	-71.9	142.8	177.8	-178.5	0	0	0	0	110.7	A666 D667	S664-A666 PolarHBondContact O-N 3.26Å; S664-A666 PolarHBondContact OG-N 3.04Å; S664-D667 WeakPolarHBondContact CB-OD2 3.33Å; S664-D667 PolarHBondContact N-OD2 3.17Å; S664-D667 WeakPolarHBondContact O-CB 3.49Å; S664-D667 PolarHBondContact O-N 2.93Å
665	M	91	Very high	90.2	Very high	13 Å²	13	82.9 Å²	82.9	6%	0.064	42%	0.419	C	S	.	.	H	α-helix	trans	-53.8	-26.8	169.5	-177.3	57.8	70.1	0	0	112	Q516 C518 Y527 Q529 D667 H668 L669	Q516-M665 HydrophobicContact CG-CE 4.06Å; Q516-M665 WeakPolarHBondContact O-CE 3.45Å; C518-M665 HydrophobicContact CB-SD 4.26Å; Y527-M665 HydrophobicContact CD1-CE 3.93Å; Y527-M665 HydrophobicContact CD1-SD 3.94Å; Y527-M665 HydrophobicContact CE1-CE 3.83Å; Y527-M665 HydrophobicContact CE1-SD 3.91Å; Q529-M665 HydrophobicContact CG-CE 3.98Å; M665-D667 VanDerWaalsContact C-N 3.28Å; M665-D667 PolarHBondContact O-N 3.4Å; M665-H668 PolarHBondContact O-N 3.05Å; M665-H668 HydrophobicContact SD-CB 4.24Å; M665-L669 HydrophobicContact CG-CD1 4.39Å; M665-L669 WeakPolarHBondContact O-CG 3.27Å; M665-L669 PolarHBondContact O-N 2.7Å
666	A	91.1	Very high	89.9	Confident	48 Å²	48	82.9 Å²	82.9	40%	0.397	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-31.1	173	0	0	0	0	0	113.3	S664 L669 K670	S664-A666 PolarHBondContact O-N 3.26Å; S664-A666 PolarHBondContact OG-N 3.04Å; A666-L669 PolarHBondContact O-N 3.27Å; A666-K670 WeakPolarHBondContact O-CG 3.17Å; A666-K670 PolarHBondContact O-N 2.92Å; A666-K670 VanDerWaalsContact O-N 3.17Å
667	D	91.3	Very high	89.2	Confident	68 Å²	68	84 Å²	84	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-75.4	-34.7	178.3	-61.7	-50.3	0	0	0	112	S664 M665 K670	S664-D667 WeakPolarHBondContact CB-OD2 3.33Å; S664-D667 PolarHBondContact N-OD2 3.17Å; S664-D667 WeakPolarHBondContact O-CB 3.49Å; S664-D667 PolarHBondContact O-N 2.93Å; M665-D667 VanDerWaalsContact C-N 3.28Å; M665-D667 PolarHBondContact O-N 3.4Å; D667-K670 IonicContact OD1-NZ 3.54Å; D667-K670 PolarHBondContact OD1-NZ 3.09Å
668	H	91.9	Very high	88.5	Confident	30 Å²	30	85 Å²	85	14%	0.139	45%	0.453	C	S	.	.	H	α-helix	trans	-62.6	-49.1	165.7	167.6	75.6	0	0	0	111.1	C518 C525 Y527 M665 K670 K671 C672	C518-H668 VanDerWaalsContact SG-CD2 3.59Å; C518-H668 PolarHBondContact SG-NE2 3.03Å; C525-H668 PolarHBondContact SG-NE2 3.41Å; C525-H668 VanDerWaalsContact SG-NE2 3.38Å; Y527-H668 WeakPolarHBondContact CB-CE1 3.36Å; Y527-H668 HydrophobicContact CD1-CB 3.84Å; Y527-H668 AromaticContact CD1-CD2 3.57Å; Y527-H668 AromaticContact CD1-CE1 3.77Å; Y527-H668 AromaticContact CD1-CG 3.28Å; Y527-H668 AromaticContact CD1-ND1 3.42Å; Y527-H668 WeakPolarHBondContact CD1-ND1 3.36Å; Y527-H668 AromaticContact CD1-NE2 3.89Å; Y527-H668 AromaticContact CD2-ND1 3.62Å; Y527-H668 HydrophobicContact CE1-CB 3.47Å; Y527-H668 VanDerWaalsContact CE1-CB 3.47Å; Y527-H668 AromaticContact CE1-CG 3.5Å; Y527-H668 AromaticContact CE1-ND1 3.88Å; Y527-H668 AromaticContact CG-CE1 3.45Å; Y527-H668 VanDerWaalsContact CG-CE1 3.45Å; Y527-H668 AromaticContact CG-CG 3.7Å; Y527-H668 AromaticContact CG-ND1 3.28Å; Y527-H668 VanDerWaalsContact CG-ND1 3.28Å; Y527-H668 AromaticContact CG-NE2 3.96Å; M665-H668 PolarHBondContact O-N 3.05Å; M665-H668 HydrophobicContact SD-CB 4.24Å; H668-K670 PolarHBondContact O-N 3.4Å; H668-K671 CarbonylContact O-C 3.45Å; H668-K671 WeakPolarHBondContact O-CA 3.36Å; H668-K671 PolarHBondContact O-N 2.89Å; H668-C672 WeakPolarHBondContact NE2-CB 3.43Å; H668-C672 PolarHBondContact O-N 3.49Å
669	L	92.4	Very high	87.7	Confident	44 Å²	44	92.7 Å²	92.7	23%	0.23	48%	0.48	C	S	.	.	H	α-helix	trans	-58.9	-31.3	-177.7	-74.6	171.6	0	0	0	113.3	L520 M665 A666 K671 C672 N675	L520-L669 HydrophobicContact CD1-CD2 3.89Å; L520-L669 HydrophobicContact CG-CD2 4.43Å; M665-L669 HydrophobicContact CG-CD1 4.39Å; M665-L669 WeakPolarHBondContact O-CG 3.27Å; M665-L669 PolarHBondContact O-N 2.7Å; A666-L669 PolarHBondContact O-N 3.27Å; L669-K671 PolarHBondContact O-N 3.38Å; L669-C672 PolarHBondContact O-N 3.34Å; L669-N675 PolarHBondContact O-ND2 2.94Å
670	K	91.9	Very high	86.7	Confident	153 Å²	153	95.4 Å²	95.4	67%	0.665	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.7	172.1	-69.9	165.3	-163.7	168.4	0	113.8	A666 D667 H668	A666-K670 WeakPolarHBondContact O-CG 3.17Å; A666-K670 PolarHBondContact O-N 2.92Å; A666-K670 VanDerWaalsContact O-N 3.17Å; D667-K670 IonicContact OD1-NZ 3.54Å; D667-K670 PolarHBondContact OD1-NZ 3.09Å; H668-K670 PolarHBondContact O-N 3.4Å
671	K	91.3	Very high	86.2	Confident	185 Å²	185	104 Å²	104	80%	0.804	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-0.1	-175.7	-58.8	-177.8	-177.4	179.5	0	113.3	H668 L669 K673	H668-K671 CarbonylContact O-C 3.45Å; H668-K671 WeakPolarHBondContact O-CA 3.36Å; H668-K671 PolarHBondContact O-N 2.89Å; L669-K671 PolarHBondContact O-N 3.38Å; K671-K673 PolarHBondContact O-N 2.89Å
672	C	90.6	Very high	85.5	Confident	12 Å²	12	104.9 Å²	104.9	8%	0.081	52%	0.522	C	S	.	.			trans	-71.3	121.6	-175.5	178.6	0	0	0	0	110.8	H668 L669 F674 N675	H668-C672 WeakPolarHBondContact NE2-CB 3.43Å; H668-C672 PolarHBondContact O-N 3.49Å; L669-C672 PolarHBondContact O-N 3.34Å; C672-F674 PolarHBondContact O-N 2.9Å; C672-F674 VanDerWaalsContact O-N 3.08Å; C672-N675 HydrophobicContact CB-CB 3.96Å; C672-N675 PolarHBondContact O-N 3.21Å
673	K	90.3	Very high	85	Confident	198 Å²	198	106.2 Å²	106.2	86%	0.861	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.6	179.3	-63.3	-178.4	-178.9	177.2	0	113.7	K671	K671-K673 PolarHBondContact O-N 2.89Å
674	F	88.6	Confident	84	Confident	78 Å²	78	108.3 Å²	108.3	34%	0.342	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-7.5	-178.9	-57	-85.3	0	0	0	113.3	L520 Y523 G524 C525 C672 T676	L520-F674 HydrophobicContact CB-CB 4.14Å; L520-F674 HydrophobicContact CD1-CB 4.41Å; Y523-F674 WeakPolarHBondContact O-CD1 3.47Å; Y523-F674 WeakPolarHBondContact O-CE1 3.42Å; G524-F674 VanDerWaalsContact C-CZ 3.47Å; G524-F674 WeakPolarHBondContact O-CE2 3.43Å; G524-F674 WeakPolarHBondContact O-CZ 3.37Å; C525-F674 HydrophobicContact CB-CD2 3.54Å; C525-F674 HydrophobicContact CB-CE2 3.99Å; C525-F674 HydrophobicContact CB-CG 4.29Å; C672-F674 PolarHBondContact O-N 2.9Å; C672-F674 VanDerWaalsContact O-N 3.08Å; F674-T676 VanDerWaalsContact C-N 3.34Å; F674-T676 PolarHBondContact O-N 2.88Å; F674-T676 VanDerWaalsContact O-N 3.09Å
675	N	90.6	Very high	82.8	Confident	54 Å²	54	108.4 Å²	108.4	29%	0.289	55%	0.545	S	S	.	.			trans	-87	70.3	-177.6	-170.8	24.6	0	0	0	111.9	L520 L669 C672 I677	L520-N675 VanDerWaalsContact CD1-CA 3.47Å; L520-N675 HydrophobicContact CD1-CB 3.49Å; L520-N675 VanDerWaalsContact CD1-CB 3.49Å; L669-N675 PolarHBondContact O-ND2 2.94Å; C672-N675 HydrophobicContact CB-CB 3.96Å; C672-N675 PolarHBondContact O-N 3.21Å; N675-I677 PolarHBondContact O-N 3.49Å
676	T	83.3	Confident	81.6	Confident	129 Å²	129	112.6 Å²	112.6	79%	0.791	57%	0.567	S	S	*	*			trans	-74.5	94.7	178.1	-53.7	0	0	0	0	110.8	F674 A678	F674-T676 VanDerWaalsContact C-N 3.34Å; F674-T676 PolarHBondContact O-N 2.88Å; F674-T676 VanDerWaalsContact O-N 3.09Å; T676-A678 PolarHBondContact O-N 2.91Å; T676-A678 VanDerWaalsContact O-N 3.09Å
677	I	79	Confident	80.1	Confident	122 Å²	122	115.9 Å²	115.9	63%	0.626	58%	0.584	S	S	*	*			trans	-75.5	98	-179.3	-56.7	174.3	0	0	0	110.5	N675 R679	N675-I677 PolarHBondContact O-N 3.49Å; I677-R679 HydrophobicContact CG2-CG 4.44Å; I677-R679 PolarHBondContact O-N 3.48Å
678	A	77.8	Confident	78.6	Confident	82 Å²	82	117 Å²	117	68%	0.678	60%	0.596	S	S	*	*			trans	-75.3	103	168.8	0	0	0	0	0	110.6	T676 R680	T676-A678 PolarHBondContact O-N 2.91Å; T676-A678 VanDerWaalsContact O-N 3.09Å; A678-R680 PolarHBondContact O-N 3.45Å
679	R	73.4	Confident	76.9	Confident	234 Å²	234	117 Å²	117	88%	0.883	60%	0.597	S	S	*	*			trans	-74.5	118.7	169.7	-66.3	-176	179.6	-178.8	0.7	109.1	I677	I677-R679 HydrophobicContact CG2-CG 4.44Å; I677-R679 PolarHBondContact O-N 3.48Å
680	R	71.8	Confident	75.1	Confident	183 Å²	183	118.9 Å²	118.9	69%	0.691	61%	0.613	S	S	*	*			trans	-105.2	126	167.4	-59.7	-155.2	-168.8	169.6	-1.5	109.1	A678 I684	A678-R680 PolarHBondContact O-N 3.45Å; R680-I684 HydrophobicContact CB-CD1 4.49Å; R680-I684 HydrophobicContact CG-CD1 4.41Å
681	E	76.8	Confident	73.2	Confident	202 Å²	202	121 Å²	121	94%	0.944	62%	0.622	S	S	*	*			trans	-83	-24.3	174.9	-59.8	-175.8	168.5	0	0	111.3
682	E	73.1	Confident	71.3	Confident	168 Å²	168	113.7 Å²	113.7	79%	0.785	59%	0.594	S	S	*	*	S	Bend	trans	-75.3	132.5	172.7	-63.2	-173.5	164.6	0	0	112	I684	E682-I684 PolarHBondContact O-N 2.98Å; E682-I684 VanDerWaalsContact O-N 3.1Å
683	A	73	Confident	69.4	Low	103 Å²	103	122.3 Å²	122.3	85%	0.851	62%	0.624	S	S	*	*			trans	-67.1	107.6	178.3	0	0	0	0	0	111.6
684	I	66	Low	67.6	Low	105 Å²	105	120.7 Å²	120.7	54%	0.538	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-75.3	125.1	174	-45.6	174.7	0	0	0	108.7	R680 E682 L686	R680-I684 HydrophobicContact CB-CD1 4.49Å; R680-I684 HydrophobicContact CG-CD1 4.41Å; E682-I684 PolarHBondContact O-N 2.98Å; E682-I684 VanDerWaalsContact O-N 3.1Å; I684-L686 PolarHBondContact O-N 2.86Å
685	P	62.8	Low	65.8	Low	66 Å²	66	122.1 Å²	122.1	43%	0.429	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-64.9	129.6	171.6	27.5	-32.9	0	0	0	109.5	M689	P685-M689 HydrophobicContact CB-CB 4.34Å
686	L	67.1	Low	64	Low	101 Å²	101	121.6 Å²	121.6	53%	0.529	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-61.7	152.6	173.2	-64.6	173.3	0	0	0	109.9	I684 C688 M689	I684-L686 PolarHBondContact O-N 2.86Å; L686-C688 PolarHBondContact O-N 3.25Å; L686-M689 HydrophobicContact CB-CG 4.13Å; L686-M689 HydrophobicContact CB-SD 3.93Å; L686-M689 HydrophobicContact CD1-SD 4.27Å; L686-M689 HydrophobicContact CG-SD 4.12Å; L686-M689 WeakPolarHBondContact O-CA 3.37Å; L686-M689 WeakPolarHBondContact O-CB 3.36Å; L686-M689 PolarHBondContact O-N 3.33Å
687	P	59.1	Low	62.5	Low	116 Å²	116	123.5 Å²	123.5	75%	0.753	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-54.6	-29.6	-179.4	-28.9	36.1	0	0	0	114.5	M689 C690	P687-M689 VanDerWaalsContact C-N 3.31Å; P687-M689 PolarHBondContact O-N 3.21Å; P687-C690 PolarHBondContact O-SG 3.38Å
688	C	59.6	Low	61.3	Low	91 Å²	91	124.4 Å²	124.4	62%	0.615	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-75.7	-11.8	174.7	57.2	0	0	0	0	114.8	L686	L686-C688 PolarHBondContact O-N 3.25Å
689	M	56.4	Low	60.1	Low	31 Å²	31	124 Å²	124	15%	0.153	63%	0.632	C	S	.	*	G	3₁₀ helix	trans	-96.3	-5.7	-179.3	-64.6	173	51.3	0	0	113.6	P685 L686 P687 F691 T692 L702	P685-M689 HydrophobicContact CB-CB 4.34Å; L686-M689 HydrophobicContact CB-CG 4.13Å; L686-M689 HydrophobicContact CB-SD 3.93Å; L686-M689 HydrophobicContact CD1-SD 4.27Å; L686-M689 HydrophobicContact CG-SD 4.12Å; L686-M689 WeakPolarHBondContact O-CA 3.37Å; L686-M689 WeakPolarHBondContact O-CB 3.36Å; L686-M689 PolarHBondContact O-N 3.33Å; P687-M689 VanDerWaalsContact C-N 3.31Å; P687-M689 PolarHBondContact O-N 3.21Å; M689-F691 PolarHBondContact O-N 3.2Å; M689-F691 VanDerWaalsContact O-N 3.13Å; M689-T692 PolarHBondContact O-N 2.97Å; M689-T692 PolarHBondContact O-OG1 3.42Å; M689-L702 HydrophobicContact CE-CD1 4.29Å; M689-L702 HydrophobicContact CE-CD2 3.72Å; M689-L702 HydrophobicContact CG-CD2 4.14Å; M689-L702 HydrophobicContact SD-CD1 3.99Å; M689-L702 HydrophobicContact SD-CD2 3.65Å; M689-L702 HydrophobicContact SD-CG 4.49Å
690	C	53.9	Low	59.1	Low	84 Å²	84	120.3 Å²	120.3	57%	0.568	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-28.2	-176	-65.5	0	0	0	0	113.5	P687	P687-C690 PolarHBondContact O-SG 3.38Å
691	F	52.6	Low	58.1	Low	196 Å²	196	115.8 Å²	115.8	86%	0.86	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-9.5	178	-62.8	-78.7	0	0	0	114.6	M689	M689-F691 PolarHBondContact O-N 3.2Å; M689-F691 VanDerWaalsContact O-N 3.13Å
692	T	52.3	Low	56.9	Low	33 Å²	33	109.9 Å²	109.9	20%	0.202	59%	0.588	C	S	.	*			trans	-121.9	19.7	-170.3	57.9	0	0	0	0	113.7	M689 E694 L695 V705	M689-T692 PolarHBondContact O-N 2.97Å; M689-T692 PolarHBondContact O-OG1 3.42Å; T692-E694 PolarHBondContact O-N 2.86Å; T692-L695 HydrophobicContact CG2-CD1 4.1Å; T692-L695 PolarHBondContact O-N 2.87Å; T692-V705 HydrophobicContact CG2-CG1 4.31Å
693	R	50.5	Low	55.9	Low	192 Å²	192	112.6 Å²	112.6	73%	0.725	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-16.1	-179.8	-163.5	177.7	178.6	-164.6	-0.4	113.9
694	E	52.5	Low	54.9	Low	164 Å²	164	111.5 Å²	111.5	77%	0.766	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-30.2	174.6	-64.4	178.6	158.6	0	0	112.8	T692	T692-E694 PolarHBondContact O-N 2.86Å
695	L	51.4	Low	54.2	Low	109 Å²	109	108.8 Å²	108.8	57%	0.571	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-15.9	-175.1	-67.9	170.7	0	0	0	114	T692	T692-L695 HydrophobicContact CG2-CD1 4.1Å; T692-L695 PolarHBondContact O-N 2.87Å
696	T	51.7	Low	53.5	Low	42 Å²	42	111.9 Å²	111.9	26%	0.258	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-2.7	-179.6	56.3	0	0	0	0	114.3	E698 G699 L702	T696-E698 PolarHBondContact O-N 2.87Å; T696-E698 VanDerWaalsContact O-N 3.13Å; T696-G699 PolarHBondContact O-N 2.99Å; T696-L702 HydrophobicContact CG2-CD2 4.36Å
697	K	52.4	Low	52.4	Low	170 Å²	170	115.6 Å²	115.6	74%	0.739	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-20.9	-178.8	-77.2	-177.3	176.8	174.1	0	114.5
698	E	52.8	Low	51.5	Low	141 Å²	141	115.9 Å²	115.9	66%	0.659	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	17	-177.2	-60	177.8	157.7	0	0	113.7	T696 R700	T696-E698 PolarHBondContact O-N 2.87Å; T696-E698 VanDerWaalsContact O-N 3.13Å; E698-R700 VanDerWaalsContact C-N 3.31Å; E698-R700 HydrophobicContact CB-CG 4.46Å; E698-R700 PolarHBondContact O-N 2.92Å; E698-R700 IonicContact OE2-CZ 3.28Å; E698-R700 VanDerWaalsContact OE2-CZ 3.28Å; E698-R700 IonicContact OE2-NE 3.08Å; E698-R700 PolarHBondContact OE2-NE 3.17Å; E698-R700 VanDerWaalsContact OE2-NE 3.08Å; E698-R700 IonicContact OE2-NH2 2.66Å; E698-R700 PolarHBondContact OE2-NH2 3.14Å
699	G	52.3	Low	50.6	Low	73 Å²	73	118.4 Å²	118.4	75%	0.753	60%	0.604	S	S	*	*			trans	71.9	17.3	175.6	0	0	0	0	0	115.4	T696	T696-G699 PolarHBondContact O-N 2.99Å
700	R	52.8	Low	49.6	Very low	156 Å²	156	124.9 Å²	124.9	59%	0.589	66%	0.662	S	S	*	*			trans	-72.8	139.4	176.8	-53.3	-170.6	-157.8	-163.6	10.3	111.2	E698	E698-R700 VanDerWaalsContact C-N 3.31Å; E698-R700 HydrophobicContact CB-CG 4.46Å; E698-R700 PolarHBondContact O-N 2.92Å; E698-R700 IonicContact OE2-CZ 3.28Å; E698-R700 VanDerWaalsContact OE2-CZ 3.28Å; E698-R700 IonicContact OE2-NE 3.08Å; E698-R700 PolarHBondContact OE2-NE 3.17Å; E698-R700 VanDerWaalsContact OE2-NE 3.08Å; E698-R700 IonicContact OE2-NH2 2.66Å; E698-R700 PolarHBondContact OE2-NH2 3.14Å
701	C	50.3	Low	49.4	Very low	89 Å²	89	127 Å²	127	60%	0.601	67%	0.667	S	S	*	*			trans	-63.5	134.1	-179.6	-179.5	0	0	0	0	112.2	R703 S704	C701-R703 PolarHBondContact O-N 3.21Å; C701-S704 PolarHBondContact O-N 3.45Å; C701-S704 PolarHBondContact O-OG 2.8Å
702	L	52.1	Low	49.3	Very low	77 Å²	77	123.3 Å²	123.3	40%	0.403	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-51.1	-28.7	177.7	-82.1	163.6	0	0	0	114.5	M689 T696 S704 V705 L706	M689-L702 HydrophobicContact CE-CD1 4.29Å; M689-L702 HydrophobicContact CE-CD2 3.72Å; M689-L702 HydrophobicContact CG-CD2 4.14Å; M689-L702 HydrophobicContact SD-CD1 3.99Å; M689-L702 HydrophobicContact SD-CD2 3.65Å; M689-L702 HydrophobicContact SD-CG 4.49Å; T696-L702 HydrophobicContact CG2-CD2 4.36Å; L702-S704 PolarHBondContact O-N 2.87Å; L702-V705 PolarHBondContact O-N 3.27Å; L702-V705 VanDerWaalsContact O-N 3.07Å; L702-L706 PolarHBondContact O-N 2.77Å
703	R	53	Low	49.1	Very low	225 Å²	225	128.3 Å²	128.3	85%	0.849	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-62.5	-19.4	177.4	-158	176.3	-171.5	179.6	3.8	113.7	C701	C701-R703 PolarHBondContact O-N 3.21Å
704	S	52.2	Low	49	Very low	80 Å²	80	124.6 Å²	124.6	56%	0.559	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-86.9	-12	175	69.7	0	0	0	0	114.2	C701 L702	C701-S704 PolarHBondContact O-N 3.45Å; C701-S704 PolarHBondContact O-OG 2.8Å; L702-S704 PolarHBondContact O-N 2.87Å
705	V	51.3	Low	48.8	Very low	49 Å²	49	122.1 Å²	122.1	30%	0.297	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.8	-34.5	-179	-174.1	0	0	0	0	110.9	T692 L702 K707	T692-V705 HydrophobicContact CG2-CG1 4.31Å; L702-V705 PolarHBondContact O-N 3.27Å; L702-V705 VanDerWaalsContact O-N 3.07Å; V705-K707 VanDerWaalsContact C-N 3.34Å; V705-K707 PolarHBondContact O-N 3.09Å
706	L	46.9	Very low	48.6	Very low	131 Å²	131	123 Å²	123	69%	0.686	68%	0.681	S	S	*	*			trans	-79.3	76.2	174.3	-62.5	174.8	0	0	0	111.4	L702	L702-L706 PolarHBondContact O-N 2.77Å
707	K	44.2	Very low	48.4	Very low	179 Å²	179	128.8 Å²	128.8	78%	0.778	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-71.7	139.5	159.1	-78	-171.4	176.3	-177.9	0	109.1	V705 V709	V705-K707 VanDerWaalsContact C-N 3.34Å; V705-K707 PolarHBondContact O-N 3.09Å; K707-V709 PolarHBondContact O-N 3.29Å
708	P	40.3	Very low	48.1	Very low	122 Å²	122	125.6 Å²	125.6	79%	0.792	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.9	169.3	27.8	-33.1	0	0	0	108.8	A710	P708-A710 PolarHBondContact O-N 3.5Å
709	V	41.6	Very low	47.7	Very low	144 Å²	144	124.3 Å²	124.3	87%	0.873	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-70.1	124.7	164.6	-177.2	0	0	0	0	106.3	K707	K707-V709 PolarHBondContact O-N 3.29Å
710	A	35.6	Very low	47.3	Very low	167 Å²	167	129 Å²	129	100%	1.38	71%	0.71	S	S	*	*			trans	-86.3	0	177.5	0	0	0	0	0	111	P708	P708-A710 PolarHBondContact O-N 3.5Å

Retrieved 710 of 710 residues in 217.4 ms (Link to these results)

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