A0A075B720_HUMAN Loading...

Ubiquitin specific peptidase 8

AlphaFold DB , UniProt , Accession A0A075B720, Species HUMAN (Homo sapiens, Human), Gene USP8, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	61.9	Low	232 Å²	232	111.4 Å²	111.4	100%	1.143	67%	0.666	S	S	*	*				0	153	0	-65.5	-157.1	80.6	0	0	108.5
2	P	40.1	Very low	64	Low	109 Å²	109	111.6 Å²	111.6	71%	0.708	65%	0.648	S	S	*	*			trans	-68.3	134	-167.1	26.5	-34.9	0	0	0	112.6	V4	P2-V4 VanDerWaalsContact C-N 3.34Å; P2-V4 PolarHBondContact O-N 2.68Å
3	A	44.7	Very low	64.9	Low	106 Å²	106	106.2 Å²	106.2	88%	0.876	62%	0.615	S	S	*	*			trans	-79.6	81.7	172.7	0	0	0	0	0	109.8	A5	A3-A5 PolarHBondContact O-N 3.09Å
4	V	46.7	Very low	66.1	Low	119 Å²	119	100.7 Å²	100.7	72%	0.721	59%	0.586	S	S	*	*			trans	-66.6	122.5	169.1	-179	0	0	0	0	108	P2 S6	P2-V4 VanDerWaalsContact C-N 3.34Å; P2-V4 PolarHBondContact O-N 2.68Å; V4-S6 PolarHBondContact O-N 3.35Å
5	A	47.2	Very low	66.8	Low	101 Å²	101	101 Å²	101	84%	0.835	60%	0.596	S	S	*	*			trans	-71.6	74.2	172.8	0	0	0	0	0	109.8	A3 V7	A3-A5 PolarHBondContact O-N 3.09Å; A5-V7 PolarHBondContact O-N 3.08Å
6	S	58.2	Low	67.6	Low	84 Å²	84	96.6 Å²	96.6	59%	0.587	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-67.4	119.9	-179.3	-170	0	0	0	0	110.2	V4	V4-S6 PolarHBondContact O-N 3.35Å
7	V	73.6	Confident	68.4	Low	120 Å²	120	93 Å²	93	73%	0.727	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-55.8	139.2	171.2	-177.6	0	0	0	0	109.3	A5	A5-V7 PolarHBondContact O-N 3.08Å
8	P	78.3	Confident	69.2	Low	49 Å²	49	96.7 Å²	96.7	32%	0.318	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-57.2	149.7	172.7	-26.1	35.9	0	0	0	112.4	E10 E56	P8-E10 PolarHBondContact O-N 3.04Å; P8-E56 HydrophobicContact CB-CG 4.38Å; P8-E56 WeakPolarHBondContact CB-OE2 3.49Å
9	K	85.1	Confident	69.8	Low	100 Å²	100	94.5 Å²	94.5	44%	0.435	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-59.2	140	-178.4	-168.6	176.2	175.3	-174.6	0	111	Y12 R54 D55 R112	K9-Y12 HydrophobicContact CD-CE1 4.48Å; K9-R54 VanDerWaalsContact CB-O 3.28Å; K9-R54 WeakPolarHBondContact CB-O 3.44Å; K9-R54 PolarHBondContact N-O 2.96Å; K9-D55 HydrophobicContact CD-CB 3.95Å; K9-D55 IonicContact NZ-OD2 2.97Å; K9-D55 PolarHBondContact NZ-OD2 3.43Å; K9-R112 PolarHBondContact O-NH1 3Å; K9-R112 PolarHBondContact O-NH2 3.25Å
10	E	83.1	Confident	70.3	Confident	167 Å²	167	89.8 Å²	89.8	78%	0.78	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-56.4	147.5	179.5	-171.2	171.5	-163.8	0	0	111.8	P8 Y12	P8-E10 PolarHBondContact O-N 3.04Å; E10-Y12 WeakPolarHBondContact O-CD1 3.33Å; E10-Y12 PolarHBondContact O-N 3.01Å
11	L	85.6	Confident	70.8	Confident	38 Å²	38	88.2 Å²	88.2	20%	0.199	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-72.7	122.4	-178.3	-61.1	171.6	0	0	0	110	E57 L109 R112 Y113 A116	L11-E57 WeakPolarHBondContact CA-OE2 3.38Å; L11-E57 HydrophobicContact CD2-CG 3.77Å; L11-L109 HydrophobicContact CD2-CD2 3.81Å; L11-R112 HydrophobicContact CD1-CB 4.09Å; L11-Y113 HydrophobicContact CB-CE1 4.43Å; L11-Y113 HydrophobicContact CD1-CD1 3.67Å; L11-Y113 HydrophobicContact CD1-CE1 3.92Å; L11-Y113 HydrophobicContact CD1-CG 4.33Å; L11-Y113 HydrophobicContact CD2-CE1 4.13Å; L11-Y113 HydrophobicContact CG-CE1 4.39Å; L11-A116 HydrophobicContact CD1-CB 4.31Å
12	Y	86.8	Confident	72.9	Confident	114 Å²	114	82.7 Å²	82.7	45%	0.447	48%	0.475	S	S	.	.			trans	-138.8	-21.8	-173.8	75.1	-80.6	0	0	0	113.5	K9 E10 D55 E57	K9-Y12 HydrophobicContact CD-CE1 4.48Å; E10-Y12 WeakPolarHBondContact O-CD1 3.33Å; E10-Y12 PolarHBondContact O-N 3.01Å; Y12-D55 WeakPolarHBondContact CE1-OD1 3.21Å; Y12-D55 WeakPolarHBondContact CE1-OD2 3.36Å; Y12-D55 PolarHBondContact OH-OD1 3.45Å; Y12-D55 PolarHBondContact OH-OD2 2.82Å; Y12-E57 VanDerWaalsContact CD1-OE2 3.31Å; Y12-E57 WeakPolarHBondContact CD1-OE2 3.36Å; Y12-E57 PolarHBondContact N-OE2 3.16Å
13	L	76.6	Confident	74.5	Confident	42 Å²	42	82.2 Å²	82.2	22%	0.22	46%	0.462	C	S	.	.	S	Bend	trans	-90.8	-24.1	-170.8	-168.1	58.6	0	0	0	112.4	L20 K23 E57 R58 V61	L13-L20 HydrophobicContact CB-CD1 4.3Å; L13-L20 HydrophobicContact CD2-CD1 3.98Å; L13-L20 HydrophobicContact CG-CD1 4.04Å; L13-K23 HydrophobicContact CG-CD 4.49Å; L13-K23 PolarHBondContact O-NZ 2.89Å; L13-E57 HydrophobicContact CB-CB 3.91Å; L13-E57 HydrophobicContact CB-CG 4.39Å; L13-E57 WeakPolarHBondContact CB-OE2 3.14Å; L13-E57 HydrophobicContact CD2-CB 4.18Å; L13-E57 PolarHBondContact N-OE1 2.77Å; L13-E57 PolarHBondContact N-OE2 3.05Å; L13-R58 HydrophobicContact CD2-CB 4.44Å; L13-V61 HydrophobicContact CD2-CG2 4.15Å
14	S	81.3	Confident	76.1	Confident	29 Å²	29	77.7 Å²	77.7	20%	0.203	42%	0.424	C	S	.	.			trans	-153.7	179.3	172	-151.8	0	0	0	0	113.3	S16 D19 E57 Y113	S14-S16 PolarHBondContact OG-O 3.31Å; S14-D19 VanDerWaalsContact OG-CB 3.27Å; S14-D19 WeakPolarHBondContact OG-CB 2.96Å; S14-E57 PolarHBondContact N-OE1 3.38Å; S14-Y113 WeakPolarHBondContact O-CE1 3.44Å
15	S	77.1	Confident	77.4	Confident	105 Å²	105	78.9 Å²	78.9	73%	0.734	42%	0.421	S	S	*	.	S	Bend	trans	-113.2	-1.9	168.7	56.4	0	0	0	0	113
16	S	79.4	Confident	78.7	Confident	31 Å²	31	75.5 Å²	75.5	22%	0.217	39%	0.391	C	S	.	.			trans	-155	150.4	173.5	88.6	0	0	0	0	112.3	S14 K18 D19 L20	S14-S16 PolarHBondContact OG-O 3.31Å; S16-K18 PolarHBondContact O-N 3.23Å; S16-K18 PolarHBondContact OG-N 2.92Å; S16-D19 PolarHBondContact O-N 3.36Å; S16-D19 VanDerWaalsContact O-N 3.13Å; S16-D19 PolarHBondContact OG-N 3.39Å; S16-D19 PolarHBondContact OG-OD2 3.05Å; S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 PolarHBondContact O-N 3.35Å
17	L	80.7	Confident	79.4	Confident	35 Å²	35	79 Å²	79	18%	0.183	40%	0.395	C	S	.	.	H	α-helix	trans	-59.4	-30	172.6	-171.1	67.3	0	0	0	112	L20 N21 Y60 L109 K110 Y113	L17-L20 HydrophobicContact CD1-CD2 4.3Å; L17-L20 PolarHBondContact O-N 2.83Å; L17-N21 WeakPolarHBondContact O-CB 3.44Å; L17-N21 PolarHBondContact O-N 3.4Å; L17-N21 PolarHBondContact O-ND2 3.12Å; L17-Y60 HydrophobicContact CD1-CD1 4.24Å; L17-Y60 HydrophobicContact CD1-CE1 3.64Å; L17-L109 HydrophobicContact CD1-CB 4.34Å; L17-K110 HydrophobicContact CD2-CB 4.35Å; L17-Y113 HydrophobicContact CB-CD2 4.3Å; L17-Y113 HydrophobicContact CB-CE2 4.28Å
18	K	82.6	Confident	79	Confident	159 Å²	159	78.6 Å²	78.6	69%	0.691	40%	0.395	S	S	*	.	H	α-helix	trans	-68	-38.1	176.7	-176.3	175.9	-178.2	176.8	0	112.2	S16	S16-K18 PolarHBondContact O-N 3.23Å; S16-K18 PolarHBondContact OG-N 2.92Å
19	D	80.6	Confident	78.5	Confident	56 Å²	56	81.5 Å²	81.5	30%	0.299	40%	0.404	S	S	.	.	H	α-helix	trans	-80.8	-28.9	176.9	-66.5	-60.3	0	0	0	112.2	S14 S16 K22	S14-D19 VanDerWaalsContact OG-CB 3.27Å; S14-D19 WeakPolarHBondContact OG-CB 2.96Å; S16-D19 PolarHBondContact O-N 3.36Å; S16-D19 VanDerWaalsContact O-N 3.13Å; S16-D19 PolarHBondContact OG-N 3.39Å; S16-D19 PolarHBondContact OG-OD2 3.05Å; D19-K22 PolarHBondContact O-N 3.41Å; D19-K22 WeakPolarHBondContact OD1-CE 3.39Å; D19-K22 IonicContact OD1-NZ 2.73Å; D19-K22 PolarHBondContact OD1-NZ 3.02Å
20	L	79.4	Confident	77.6	Confident	0 Å²	0	87.3 Å²	87.3	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-63.7	-42.5	169.3	-162.7	67.4	0	0	0	111.3	L13 S16 L17 K22 K23 E57 Y60 V61 L109	L13-L20 HydrophobicContact CB-CD1 4.3Å; L13-L20 HydrophobicContact CD2-CD1 3.98Å; L13-L20 HydrophobicContact CG-CD1 4.04Å; S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 PolarHBondContact O-N 3.35Å; L17-L20 HydrophobicContact CD1-CD2 4.3Å; L17-L20 PolarHBondContact O-N 2.83Å; L20-K22 VanDerWaalsContact C-N 3.35Å; L20-K22 PolarHBondContact O-N 3.45Å; L20-K23 WeakPolarHBondContact O-CB 3.28Å; L20-K23 PolarHBondContact O-N 3.36Å; L20-E57 HydrophobicContact CD1-CB 4.3Å; L20-E57 HydrophobicContact CD2-CB 4.42Å; L20-E57 HydrophobicContact CD2-CG 4.49Å; L20-Y60 HydrophobicContact CD2-CD1 3.53Å; L20-Y60 HydrophobicContact CD2-CE1 4.14Å; L20-Y60 HydrophobicContact CD2-CG 4.39Å; L20-Y60 HydrophobicContact CG-CD1 4.11Å; L20-V61 HydrophobicContact CD1-CG2 3.41Å; L20-V61 VanDerWaalsContact CD1-CG2 3.41Å; L20-V61 HydrophobicContact CD2-CG2 4.29Å; L20-V61 HydrophobicContact CG-CG2 3.55Å; L20-L109 HydrophobicContact CD2-CD1 3.72Å
21	N	81.6	Confident	77.4	Confident	56 Å²	56	82.2 Å²	82.2	30%	0.299	41%	0.407	S	S	.	.	H	α-helix	trans	-61	-35.6	176.1	-83.8	-28.5	0	0	0	113.9	L17 K23 T24 Y60	L17-N21 WeakPolarHBondContact O-CB 3.44Å; L17-N21 PolarHBondContact O-N 3.4Å; L17-N21 PolarHBondContact O-ND2 3.12Å; N21-K23 PolarHBondContact O-N 3.15Å; N21-K23 VanDerWaalsContact O-N 3.1Å; N21-T24 PolarHBondContact O-N 3.14Å; N21-T24 PolarHBondContact O-OG1 2.82Å; N21-Y60 WeakPolarHBondContact OD1-CE1 3.4Å; N21-Y60 PolarHBondContact OD1-OH 2.89Å; N21-Y60 VanDerWaalsContact OD1-OH 3.04Å
22	K	81.6	Confident	77.4	Confident	116 Å²	116	83.1 Å²	83.1	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-58.3	-26.2	173.7	-63	170.5	-172	170.1	0	112.8	D19 L20 T24	D19-K22 PolarHBondContact O-N 3.41Å; D19-K22 WeakPolarHBondContact OD1-CE 3.39Å; D19-K22 IonicContact OD1-NZ 2.73Å; D19-K22 PolarHBondContact OD1-NZ 3.02Å; L20-K22 VanDerWaalsContact C-N 3.35Å; L20-K22 PolarHBondContact O-N 3.45Å; K22-T24 VanDerWaalsContact C-N 3.31Å
23	K	74.4	Confident	77.4	Confident	100 Å²	100	77.8 Å²	77.8	44%	0.435	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.1	179.1	-58	-175.8	175.8	-172.8	0	113.4	L13 L20 N21 V61	L13-K23 HydrophobicContact CG-CD 4.49Å; L13-K23 PolarHBondContact O-NZ 2.89Å; L20-K23 WeakPolarHBondContact O-CB 3.28Å; L20-K23 PolarHBondContact O-N 3.36Å; N21-K23 PolarHBondContact O-N 3.15Å; N21-K23 VanDerWaalsContact O-N 3.1Å; K23-V61 HydrophobicContact CB-CG1 4.42Å
24	T	77.3	Confident	78	Confident	11 Å²	11	81.8 Å²	81.8	7%	0.067	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-16.9	179	76.6	0	0	0	0	112.6	N21 K22 V26 V61 M64	N21-T24 PolarHBondContact O-N 3.14Å; N21-T24 PolarHBondContact O-OG1 2.82Å; K22-T24 VanDerWaalsContact C-N 3.31Å; T24-V26 PolarHBondContact O-N 3.17Å; T24-V61 HydrophobicContact CG2-CB 4.49Å; T24-V61 HydrophobicContact CG2-CG1 4.34Å; T24-V61 HydrophobicContact CG2-CG2 4.45Å; T24-M64 HydrophobicContact CG2-CB 3.78Å; T24-M64 HydrophobicContact CG2-CG 3.74Å
25	E	75	Confident	78.3	Confident	143 Å²	143	83 Å²	83	67%	0.668	42%	0.42	S	S	*	.			trans	-56	134.1	-179.6	-67.6	-176.3	-152	0	0	112.1
26	V	74.3	Confident	79	Confident	31 Å²	31	78.6 Å²	78.6	19%	0.188	39%	0.388	C	S	.	.			trans	-122.3	122.1	175.3	-75.5	0	0	0	0	109.7	T24 K65 T68 V69 L72	T24-V26 PolarHBondContact O-N 3.17Å; V26-K65 HydrophobicContact CG1-CD 4.33Å; V26-K65 HydrophobicContact CG1-CG 3.92Å; V26-T68 HydrophobicContact CG2-CG2 3.67Å; V26-V69 HydrophobicContact CB-CG2 4.45Å; V26-V69 HydrophobicContact CG1-CG2 4Å; V26-V69 HydrophobicContact CG2-CG2 4Å; V26-L72 HydrophobicContact CG2-CD1 4.42Å
27	K	72.8	Confident	79.5	Confident	158 Å²	158	77.4 Å²	77.4	69%	0.687	38%	0.379	S	S	*	.			trans	-68.5	133.4	178.4	-70.2	-177.6	179.2	179.9	0	110.1	E29 Y36	K27-E29 HydrophobicContact CB-CG 4.09Å; K27-E29 WeakPolarHBondContact CB-OE1 3.22Å; K27-E29 PolarHBondContact O-N 2.9Å; K27-Y36 PolarHBondContact O-OH 2.99Å; K27-Y36 VanDerWaalsContact O-OH 3.08Å
28	P	66.4	Low	80	Confident	111 Å²	111	82.6 Å²	82.6	72%	0.721	40%	0.402	S	S	*	.			trans	-72.7	73.5	173.2	-18.3	33	0	0	0	112	L72	P28-L72 HydrophobicContact CB-CD1 4.1Å; P28-L72 HydrophobicContact CG-CD1 3.97Å
29	E	67.2	Low	80.4	Confident	109 Å²	109	77.7 Å²	77.7	51%	0.509	39%	0.388	S	S	.	.			trans	-78.8	172.4	178.2	-72.6	156.7	-168.1	0	0	111.3	K27 I31 Y36	K27-E29 HydrophobicContact CB-CG 4.09Å; K27-E29 WeakPolarHBondContact CB-OE1 3.22Å; K27-E29 PolarHBondContact O-N 2.9Å; E29-I31 HydrophobicContact CB-CD1 3.97Å; E29-I31 HydrophobicContact CB-CG1 4Å; E29-I31 PolarHBondContact O-N 2.67Å; E29-Y36 PolarHBondContact N-OH 3.34Å
30	K	66.7	Low	80.9	Confident	223 Å²	223	75.1 Å²	75.1	97%	0.97	37%	0.374	S	S	*	.	S	Bend	trans	-70.3	28.5	179.8	-62.9	-175.5	179.1	180	0	113.8
31	I	77	Confident	81.6	Confident	59 Å²	59	78 Å²	78	30%	0.303	39%	0.389	S	S	.	.			trans	-78.9	136	-177.4	-63.5	172.2	0	0	0	109.6	E29 Y36 R76	E29-I31 HydrophobicContact CB-CD1 3.97Å; E29-I31 HydrophobicContact CB-CG1 4Å; E29-I31 PolarHBondContact O-N 2.67Å; I31-Y36 HydrophobicContact CB-CD2 4.07Å; I31-Y36 HydrophobicContact CB-CE2 3.59Å; I31-Y36 HydrophobicContact CG2-CD1 4.44Å; I31-Y36 HydrophobicContact CG2-CD2 3.72Å; I31-Y36 HydrophobicContact CG2-CE1 4.46Å; I31-Y36 HydrophobicContact CG2-CE2 3.75Å; I31-Y36 HydrophobicContact CG2-CG 4.09Å; I31-R76 PolarHBondContact O-NH1 2.74Å; I31-R76 PolarHBondContact O-NH2 3.33Å
32	S	86.3	Confident	82.2	Confident	57 Å²	57	82.9 Å²	82.9	40%	0.399	41%	0.408	S	S	.	.			trans	-67.8	152.8	179.7	90.6	0	0	0	0	112	K34 S35 Y36	S32-K34 VanDerWaalsContact C-N 3.28Å; S32-K34 PolarHBondContact O-N 3.37Å; S32-S35 WeakPolarHBondContact O-CB 3.1Å; S32-S35 PolarHBondContact O-N 2.71Å; S32-S35 VanDerWaalsContact O-N 3.1Å; S32-S35 WeakPolarHBondContact OG-CB 3.14Å; S32-S35 PolarHBondContact OG-N 2.85Å; S32-S35 PolarHBondContact OG-OG 3.33Å; S32-Y36 PolarHBondContact O-N 3.28Å
33	T	87.4	Confident	82.8	Confident	2 Å²	2	78.7 Å²	78.7	1%	0.012	39%	0.391	C	S	.	.	H	α-helix	trans	-62.5	-36.5	178.5	-58.3	0	0	0	0	111.9	S35 Y36 V37 I73 R76 D78 F79 F86	T33-S35 PolarHBondContact O-N 3.22Å; T33-Y36 PolarHBondContact O-N 2.86Å; T33-V37 WeakPolarHBondContact O-CG2 3.42Å; T33-V37 PolarHBondContact O-N 3.43Å; T33-I73 HydrophobicContact CG2-CB 4.17Å; T33-I73 HydrophobicContact CG2-CG2 4.28Å; T33-R76 WeakPolarHBondContact OG1-CD 3.28Å; T33-R76 PolarHBondContact OG1-NH1 3.19Å; T33-D78 WeakPolarHBondContact CB-OD2 3.28Å; T33-D78 VanDerWaalsContact OG1-CG 3.24Å; T33-D78 PolarHBondContact OG1-OD1 3.47Å; T33-D78 VanDerWaalsContact OG1-OD1 3.12Å; T33-D78 PolarHBondContact OG1-OD2 3.09Å; T33-F79 HydrophobicContact CG2-CB 4.09Å; T33-F79 HydrophobicContact CG2-CD2 3.92Å; T33-F86 HydrophobicContact CG2-CE2 4.21Å; T33-F86 HydrophobicContact CG2-CZ 4.13Å
34	K	88.4	Confident	83.9	Confident	126 Å²	126	75 Å²	75	55%	0.548	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-40.2	172.7	-66.2	-177.5	178.6	-178.2	0	112	S32 V37 H38 F86	S32-K34 VanDerWaalsContact C-N 3.28Å; S32-K34 PolarHBondContact O-N 3.37Å; K34-V37 PolarHBondContact O-N 3.46Å; K34-H38 PolarHBondContact O-N 3.5Å; K34-F86 HydrophobicContact CG-CE1 4.04Å; K34-F86 HydrophobicContact CG-CZ 4.19Å
35	S	88.4	Confident	84.7	Confident	56 Å²	56	80.9 Å²	80.9	39%	0.392	40%	0.399	S	S	.	.	H	α-helix	trans	-65.4	-40.7	175.7	-53.4	0	0	0	0	112.3	S32 T33 H38 S39	S32-S35 WeakPolarHBondContact O-CB 3.1Å; S32-S35 PolarHBondContact O-N 2.71Å; S32-S35 VanDerWaalsContact O-N 3.1Å; S32-S35 WeakPolarHBondContact OG-CB 3.14Å; S32-S35 PolarHBondContact OG-N 2.85Å; S32-S35 PolarHBondContact OG-OG 3.33Å; T33-S35 PolarHBondContact O-N 3.22Å; S35-H38 PolarHBondContact O-N 3.44Å; S35-S39 WeakPolarHBondContact O-CB 3.27Å; S35-S39 PolarHBondContact O-N 2.92Å; S35-S39 PolarHBondContact O-OG 3.11Å
36	Y	90.5	Very high	85.7	Confident	12 Å²	12	75.5 Å²	75.5	5%	0.047	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-40.6	173	-85.1	-65	0	0	0	112.5	K27 E29 I31 S32 T33 S39 A40 V69 L72 I73	K27-Y36 PolarHBondContact O-OH 2.99Å; K27-Y36 VanDerWaalsContact O-OH 3.08Å; E29-Y36 PolarHBondContact N-OH 3.34Å; I31-Y36 HydrophobicContact CB-CD2 4.07Å; I31-Y36 HydrophobicContact CB-CE2 3.59Å; I31-Y36 HydrophobicContact CG2-CD1 4.44Å; I31-Y36 HydrophobicContact CG2-CD2 3.72Å; I31-Y36 HydrophobicContact CG2-CE1 4.46Å; I31-Y36 HydrophobicContact CG2-CE2 3.75Å; I31-Y36 HydrophobicContact CG2-CG 4.09Å; S32-Y36 PolarHBondContact O-N 3.28Å; T33-Y36 PolarHBondContact O-N 2.86Å; Y36-S39 WeakPolarHBondContact O-CB 3.41Å; Y36-S39 PolarHBondContact O-N 3.12Å; Y36-A40 WeakPolarHBondContact O-CB 3.49Å; Y36-A40 PolarHBondContact O-N 2.88Å; Y36-V69 HydrophobicContact CD1-CG1 3.83Å; Y36-V69 HydrophobicContact CD1-CG2 4.44Å; Y36-V69 HydrophobicContact CG-CG1 4.34Å; Y36-L72 HydrophobicContact CD2-CD2 4.25Å; Y36-L72 HydrophobicContact CE2-CD2 3.88Å; Y36-I73 VanDerWaalsContact CB-CG2 3.49Å; Y36-I73 HydrophobicContact CD2-CG2 4.01Å; Y36-I73 HydrophobicContact CG-CG2 3.89Å
37	V	91.6	Very high	86.6	Confident	6 Å²	6	74 Å²	74	4%	0.036	37%	0.367	C	S	.	.	H	α-helix	trans	-61.5	-46.3	175.2	167.4	0	0	0	0	111.3	T33 K34 S39 A40 L41 I73 F86 I89 L90	T33-V37 WeakPolarHBondContact O-CG2 3.42Å; T33-V37 PolarHBondContact O-N 3.43Å; K34-V37 PolarHBondContact O-N 3.46Å; V37-S39 VanDerWaalsContact C-N 3.31Å; V37-S39 PolarHBondContact O-N 3.39Å; V37-A40 WeakPolarHBondContact O-CB 3.48Å; V37-A40 PolarHBondContact O-N 3.36Å; V37-L41 PolarHBondContact O-N 3.14Å; V37-I73 HydrophobicContact CG2-CD1 3.66Å; V37-F86 HydrophobicContact CG1-CD1 4.5Å; V37-F86 HydrophobicContact CG2-CD1 3.76Å; V37-F86 HydrophobicContact CG2-CE1 4.23Å; V37-F86 HydrophobicContact CG2-CG 4.41Å; V37-I89 HydrophobicContact CG1-CB 4.43Å; V37-I89 HydrophobicContact CG1-CG2 3.61Å; V37-L90 HydrophobicContact CG1-CD2 4Å; V37-L90 HydrophobicContact CG1-CG 4.15Å; V37-L90 HydrophobicContact CG2-CD1 4.42Å
38	H	90.4	Very high	87.7	Confident	144 Å²	144	68 Å²	68	67%	0.667	34%	0.341	S	S	*	.	H	α-helix	trans	-65.6	-34.7	177.4	-151.8	85.5	0	0	0	112.4	K34 S35 K42	K34-H38 PolarHBondContact O-N 3.5Å; S35-H38 PolarHBondContact O-N 3.44Å; H38-K42 PolarHBondContact O-N 3.14Å
39	S	90.4	Very high	89	Confident	56 Å²	56	66.2 Å²	66.2	39%	0.392	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-41.8	172	-56.4	0	0	0	0	111.9	S35 Y36 V37 K42 I43	S35-S39 WeakPolarHBondContact O-CB 3.27Å; S35-S39 PolarHBondContact O-N 2.92Å; S35-S39 PolarHBondContact O-OG 3.11Å; Y36-S39 WeakPolarHBondContact O-CB 3.41Å; Y36-S39 PolarHBondContact O-N 3.12Å; V37-S39 VanDerWaalsContact C-N 3.31Å; V37-S39 PolarHBondContact O-N 3.39Å; S39-K42 PolarHBondContact O-N 2.84Å; S39-I43 WeakPolarHBondContact O-CD1 3.45Å; S39-I43 VanDerWaalsContact O-CG1 3.24Å; S39-I43 WeakPolarHBondContact O-CG1 3.42Å; S39-I43 PolarHBondContact O-N 2.99Å
40	A	92.8	Very high	90.2	Very high	2 Å²	2	61 Å²	61	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-43.3	178	0	0	0	0	0	111.4	Y36 V37 K42 I43 F44 Y66 V69 L90	Y36-A40 WeakPolarHBondContact O-CB 3.49Å; Y36-A40 PolarHBondContact O-N 2.88Å; V37-A40 WeakPolarHBondContact O-CB 3.48Å; V37-A40 PolarHBondContact O-N 3.36Å; A40-K42 VanDerWaalsContact C-N 3.32Å; A40-K42 PolarHBondContact O-N 2.78Å; A40-I43 PolarHBondContact O-N 3.22Å; A40-F44 WeakPolarHBondContact O-CB 3.49Å; A40-F44 PolarHBondContact O-N 2.65Å; A40-Y66 HydrophobicContact CB-CD2 3.82Å; A40-Y66 HydrophobicContact CB-CE2 3.79Å; A40-Y66 VanDerWaalsContact O-CD2 3.24Å; A40-Y66 WeakPolarHBondContact O-CD2 3.28Å; A40-V69 HydrophobicContact CB-CG1 4.12Å; A40-L90 HydrophobicContact CB-CD2 3.98Å
41	L	93.1	Very high	91.4	Very high	60 Å²	60	53.3 Å²	53.3	31%	0.314	26%	0.264	S	S	.	.	H	α-helix	trans	-57	-44.1	173.5	-71.1	175.3	0	0	0	112.5	V37 F44 K45 I89	V37-L41 PolarHBondContact O-N 3.14Å; L41-F44 PolarHBondContact O-N 3.48Å; L41-K45 PolarHBondContact O-N 3.22Å; L41-I89 HydrophobicContact CD1-CG2 3.91Å
42	K	94.8	Very high	92.1	Very high	158 Å²	158	56.1 Å²	56.1	69%	0.687	28%	0.279	S	S	*	.	H	α-helix	trans	-65.1	-43.2	176.2	-172.3	174.1	-178.7	176.8	0	112.1	H38 S39 A40 K45 T46	H38-K42 PolarHBondContact O-N 3.14Å; S39-K42 PolarHBondContact O-N 2.84Å; A40-K42 VanDerWaalsContact C-N 3.32Å; A40-K42 PolarHBondContact O-N 2.78Å; K42-K45 PolarHBondContact O-N 2.92Å; K42-T46 PolarHBondContact O-N 2.99Å; K42-T46 VanDerWaalsContact O-N 3.07Å; K42-T46 PolarHBondContact O-OG1 3.12Å
43	I	94.5	Very high	92.3	Very high	29 Å²	29	58.8 Å²	58.8	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-45.6	177.4	-68.6	162.3	0	0	0	110.7	S39 A40 T46 A47 L62 K65	S39-I43 WeakPolarHBondContact O-CD1 3.45Å; S39-I43 VanDerWaalsContact O-CG1 3.24Å; S39-I43 WeakPolarHBondContact O-CG1 3.42Å; S39-I43 PolarHBondContact O-N 2.99Å; A40-I43 PolarHBondContact O-N 3.22Å; I43-T46 PolarHBondContact O-N 2.86Å; I43-A47 WeakPolarHBondContact O-CB 3.12Å; I43-A47 PolarHBondContact O-N 3.04Å; I43-L62 HydrophobicContact CG2-CB 4.12Å; I43-L62 HydrophobicContact CG2-CD2 4.05Å; I43-L62 WeakPolarHBondContact CG2-O 3.23Å; I43-K65 HydrophobicContact CD1-CG 4.37Å
44	F	95.9	Very high	92.4	Very high	21 Å²	21	65.9 Å²	65.9	9%	0.092	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-44.6	178.8	-173.7	-97.8	0	0	0	111.9	A40 L41 T46 A47 E48 Y63 Y66 N94 K97 A98	A40-F44 WeakPolarHBondContact O-CB 3.49Å; A40-F44 PolarHBondContact O-N 2.65Å; L41-F44 PolarHBondContact O-N 3.48Å; F44-T46 VanDerWaalsContact C-N 3.34Å; F44-T46 PolarHBondContact O-N 3.33Å; F44-A47 WeakPolarHBondContact O-CB 3.27Å; F44-A47 PolarHBondContact O-N 3.41Å; F44-A47 VanDerWaalsContact O-N 3.15Å; F44-E48 HydrophobicContact CD1-CG 4.38Å; F44-E48 HydrophobicContact CE1-CG 3.99Å; F44-E48 HydrophobicContact CZ-CG 4.28Å; F44-E48 PolarHBondContact O-N 2.95Å; F44-Y63 HydrophobicContact CD2-CD1 4.38Å; F44-Y63 HydrophobicContact CD2-CE1 4.17Å; F44-Y63 HydrophobicContact CE2-CD1 4.38Å; F44-Y63 AromaticContact CE2-CE1 3.94Å; F44-Y63 HydrophobicContact CE2-CE1 3.94Å; F44-Y66 HydrophobicContact CB-CD2 3.69Å; F44-Y66 HydrophobicContact CB-CE2 3.73Å; F44-Y66 HydrophobicContact CD2-CD2 4.31Å; F44-Y66 HydrophobicContact CD2-CE2 4.24Å; F44-Y66 HydrophobicContact CD2-CG 4.49Å; F44-Y66 HydrophobicContact CG-CD2 4.43Å; F44-Y66 HydrophobicContact CG-CE2 4.25Å; F44-N94 HydrophobicContact CD1-CB 4.28Å; F44-N94 HydrophobicContact CD2-CB 4.38Å; F44-N94 HydrophobicContact CE1-CB 3.8Å; F44-N94 HydrophobicContact CE2-CB 3.92Å; F44-N94 VanDerWaalsContact CE2-O 3.31Å; F44-N94 WeakPolarHBondContact CE2-O 3.09Å; F44-N94 HydrophobicContact CZ-CB 3.61Å; F44-K97 HydrophobicContact CZ-CD 4.48Å; F44-A98 HydrophobicContact CD2-CB 4.16Å; F44-A98 HydrophobicContact CE2-CB 4.02Å
45	K	95.4	Very high	92.5	Very high	135 Å²	135	60.1 Å²	60.1	59%	0.587	29%	0.291	S	S	*	.	H	α-helix	trans	-57.8	-47.1	175.6	-172.8	-177.6	178.5	-166.5	0	111.2	L41 K42 A47 E48 E49	L41-K45 PolarHBondContact O-N 3.22Å; K42-K45 PolarHBondContact O-N 2.92Å; K45-A47 VanDerWaalsContact C-N 3.31Å; K45-A47 PolarHBondContact O-N 3.36Å; K45-E48 PolarHBondContact O-N 2.86Å; K45-E49 WeakPolarHBondContact CE-OE1 3.5Å; K45-E49 IonicContact NZ-OE1 3.78Å; K45-E49 WeakPolarHBondContact O-CG 3.22Å; K45-E49 PolarHBondContact O-N 3.22Å
46	T	94.6	Very high	92.7	Very high	30 Å²	30	58.4 Å²	58.4	18%	0.184	28%	0.276	C	S	.	.	H	α-helix	trans	-72.6	-23	178.8	-57.7	0	0	0	0	113.4	K42 I43 F44 E49 C50 L62	K42-T46 PolarHBondContact O-N 2.99Å; K42-T46 VanDerWaalsContact O-N 3.07Å; K42-T46 PolarHBondContact O-OG1 3.12Å; I43-T46 PolarHBondContact O-N 2.86Å; F44-T46 VanDerWaalsContact C-N 3.34Å; F44-T46 PolarHBondContact O-N 3.33Å; T46-E49 WeakPolarHBondContact CA-OE2 3.5Å; T46-E49 WeakPolarHBondContact CB-OE2 3.28Å; T46-E49 PolarHBondContact OG1-OE2 3.49Å; T46-C50 PolarHBondContact O-N 2.94Å; T46-C50 PolarHBondContact O-SG 3.43Å; T46-L62 HydrophobicContact CG2-CD1 3.77Å
47	A	95	Very high	92.6	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-43.5	169	0	0	0	0	0	111.6	I43 F44 K45 C50 R51 L62 Y63	I43-A47 WeakPolarHBondContact O-CB 3.12Å; I43-A47 PolarHBondContact O-N 3.04Å; F44-A47 WeakPolarHBondContact O-CB 3.27Å; F44-A47 PolarHBondContact O-N 3.41Å; F44-A47 VanDerWaalsContact O-N 3.15Å; K45-A47 VanDerWaalsContact C-N 3.31Å; K45-A47 PolarHBondContact O-N 3.36Å; A47-C50 PolarHBondContact O-N 3.26Å; A47-R51 WeakPolarHBondContact O-CB 3.3Å; A47-R51 PolarHBondContact O-N 2.9Å; A47-L62 HydrophobicContact CB-CB 3.63Å; A47-Y63 HydrophobicContact CB-CD1 3.61Å; A47-Y63 HydrophobicContact CB-CD2 3.97Å; A47-Y63 HydrophobicContact CB-CE1 3.5Å; A47-Y63 HydrophobicContact CB-CE2 3.86Å; A47-Y63 HydrophobicContact CB-CG 3.85Å
48	E	94.6	Very high	92.6	Very high	31 Å²	31	62.4 Å²	62.4	15%	0.145	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-41.7	173.6	-69.7	-65.7	148.5	0	0	112.3	F44 K45 R51 L52 Y63 K97	F44-E48 HydrophobicContact CD1-CG 4.38Å; F44-E48 HydrophobicContact CE1-CG 3.99Å; F44-E48 HydrophobicContact CZ-CG 4.28Å; F44-E48 PolarHBondContact O-N 2.95Å; K45-E48 PolarHBondContact O-N 2.86Å; E48-R51 PolarHBondContact O-N 2.92Å; E48-R51 IonicContact OE1-NE 3.36Å; E48-R51 IonicContact OE2-CZ 2.7Å; E48-R51 VanDerWaalsContact OE2-CZ 3.24Å; E48-R51 IonicContact OE2-NE 3.56Å; E48-R51 PolarHBondContact OE2-NE 3.02Å; E48-R51 IonicContact OE2-NH2 3.94Å; E48-R51 PolarHBondContact OE2-NH2 3Å; E48-L52 WeakPolarHBondContact O-CG 3.47Å; E48-L52 PolarHBondContact O-N 3.47Å; E48-Y63 PolarHBondContact OE1-OH 2.68Å; E48-K97 WeakPolarHBondContact OE1-CE 3.45Å; E48-K97 IonicContact OE1-NZ 2.66Å; E48-K97 PolarHBondContact OE1-NZ 2.78Å; E48-K97 IonicContact OE2-NZ 3.46Å; E48-K97 PolarHBondContact OE2-NZ 2.87Å
49	E	94.3	Very high	92.8	Very high	74 Å²	74	55.6 Å²	55.6	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-56.2	-52.2	172.6	-68.1	160.6	174.1	0	0	110.2	K45 T46 R51 L52 D53	K45-E49 WeakPolarHBondContact CE-OE1 3.5Å; K45-E49 IonicContact NZ-OE1 3.78Å; K45-E49 WeakPolarHBondContact O-CG 3.22Å; K45-E49 PolarHBondContact O-N 3.22Å; T46-E49 WeakPolarHBondContact CA-OE2 3.5Å; T46-E49 WeakPolarHBondContact CB-OE2 3.28Å; T46-E49 PolarHBondContact OG1-OE2 3.49Å; E49-R51 VanDerWaalsContact C-N 3.33Å; E49-R51 PolarHBondContact O-N 3.05Å; E49-L52 PolarHBondContact O-N 2.96Å; E49-D53 VanDerWaalsContact O-CG 3.26Å; E49-D53 PolarHBondContact O-N 3.32Å
50	C	92.3	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-37.5	177.5	-63	0	0	0	0	113.7	T46 A47 L52 D53 R54 D55 R58 A59	T46-C50 PolarHBondContact O-N 2.94Å; T46-C50 PolarHBondContact O-SG 3.43Å; A47-C50 PolarHBondContact O-N 3.26Å; C50-L52 VanDerWaalsContact C-N 3.32Å; C50-D53 CarbonylContact O-C 3.53Å; C50-D53 PolarHBondContact O-N 3.15Å; C50-R54 PolarHBondContact O-N 2.94Å; C50-R54 VanDerWaalsContact O-N 3.09Å; C50-D55 HydrophobicContact CB-CB 4.3Å; C50-D55 PolarHBondContact O-N 2.99Å; C50-R58 HydrophobicContact CB-CB 4.49Å; C50-R58 PolarHBondContact SG-NE 3.31Å; C50-R58 PolarHBondContact SG-NH2 3.11Å; C50-A59 HydrophobicContact CB-CB 3.71Å
51	R	92.1	Very high	93.1	Very high	62 Å²	62	53.9 Å²	53.9	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-34.5	179.1	-171.7	-169.7	59.4	72.4	10.9	111.5	A47 E48 E49 A59 Y63 E101	A47-R51 WeakPolarHBondContact O-CB 3.3Å; A47-R51 PolarHBondContact O-N 2.9Å; E48-R51 PolarHBondContact O-N 2.92Å; E48-R51 IonicContact OE1-NE 3.36Å; E48-R51 IonicContact OE2-CZ 2.7Å; E48-R51 VanDerWaalsContact OE2-CZ 3.24Å; E48-R51 IonicContact OE2-NE 3.56Å; E48-R51 PolarHBondContact OE2-NE 3.02Å; E48-R51 IonicContact OE2-NH2 3.94Å; E48-R51 PolarHBondContact OE2-NH2 3Å; E49-R51 VanDerWaalsContact C-N 3.33Å; E49-R51 PolarHBondContact O-N 3.05Å; R51-A59 HydrophobicContact CB-CB 4.32Å; R51-Y63 HydrophobicContact CB-CE2 4.25Å; R51-Y63 WeakPolarHBondContact CD-OH 3.38Å; R51-Y63 PolarHBondContact NE-OH 3.25Å; R51-E101 WeakPolarHBondContact CD-OE1 3.33Å; R51-E101 WeakPolarHBondContact CD-OE2 3.35Å; R51-E101 IonicContact NE-OE1 3.88Å
52	L	92.1	Very high	93.2	Very high	117 Å²	117	52.3 Å²	52.3	61%	0.613	24%	0.237	S	C	*	.	H	α-helix	trans	-72.2	-42.7	172.3	-68	170.7	0	0	0	111.3	E48 E49 C50 R54	E48-L52 WeakPolarHBondContact O-CG 3.47Å; E48-L52 PolarHBondContact O-N 3.47Å; E49-L52 PolarHBondContact O-N 2.96Å; C50-L52 VanDerWaalsContact C-N 3.32Å; L52-R54 PolarHBondContact O-N 3.24Å; L52-R54 VanDerWaalsContact O-N 3.1Å
53	D	90.1	Very high	93.2	Very high	113 Å²	113	44.8 Å²	44.8	60%	0.604	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.6	174.8	-65.1	-19.6	0	0	0	114.2	E49 C50 D55	E49-D53 VanDerWaalsContact O-CG 3.26Å; E49-D53 PolarHBondContact O-N 3.32Å; C50-D53 CarbonylContact O-C 3.53Å; C50-D53 PolarHBondContact O-N 3.15Å; D53-D55 PolarHBondContact O-N 3.48Å
54	R	88.4	Confident	93.2	Very high	151 Å²	151	45.4 Å²	45.4	57%	0.57	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	25.4	-175.4	-52.5	-59.5	177.2	143.3	-1.1	114.5	K9 C50 L52 E56	K9-R54 VanDerWaalsContact CB-O 3.28Å; K9-R54 WeakPolarHBondContact CB-O 3.44Å; K9-R54 PolarHBondContact N-O 2.96Å; C50-R54 PolarHBondContact O-N 2.94Å; C50-R54 VanDerWaalsContact O-N 3.09Å; L52-R54 PolarHBondContact O-N 3.24Å; L52-R54 VanDerWaalsContact O-N 3.1Å; R54-E56 PolarHBondContact O-N 2.92Å
55	D	92.3	Very high	93.1	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.027	22%	0.217	C	C	.	.			trans	-84.8	78.5	171.3	-165.7	-40.3	0	0	0	109.3	K9 Y12 C50 D53 E57 R58 A59	K9-D55 HydrophobicContact CD-CB 3.95Å; K9-D55 IonicContact NZ-OD2 2.97Å; K9-D55 PolarHBondContact NZ-OD2 3.43Å; Y12-D55 WeakPolarHBondContact CE1-OD1 3.21Å; Y12-D55 WeakPolarHBondContact CE1-OD2 3.36Å; Y12-D55 PolarHBondContact OH-OD1 3.45Å; Y12-D55 PolarHBondContact OH-OD2 2.82Å; C50-D55 HydrophobicContact CB-CB 4.3Å; C50-D55 PolarHBondContact O-N 2.99Å; D53-D55 PolarHBondContact O-N 3.48Å; D55-E57 PolarHBondContact O-N 2.74Å; D55-R58 HydrophobicContact CB-CB 4.42Å; D55-R58 PolarHBondContact O-N 2.9Å; D55-R58 WeakPolarHBondContact OD1-CB 3.3Å; D55-R58 PolarHBondContact OD1-N 3.28Å; D55-A59 WeakPolarHBondContact O-CB 3.45Å; D55-A59 PolarHBondContact O-N 3.46Å
56	E	90.6	Very high	93	Very high	20 Å²	20	41.1 Å²	41.1	9%	0.093	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-40.9	-173.7	-68.3	-172.4	116.2	0	0	112.8	P8 R54 Y60 L105 S108 L109 R112	P8-E56 HydrophobicContact CB-CG 4.38Å; P8-E56 WeakPolarHBondContact CB-OE2 3.49Å; R54-E56 PolarHBondContact O-N 2.92Å; E56-Y60 VanDerWaalsContact O-CB 3.26Å; E56-Y60 WeakPolarHBondContact O-CB 3.38Å; E56-Y60 PolarHBondContact O-N 3.44Å; E56-L105 HydrophobicContact CB-CD2 3.84Å; E56-L105 HydrophobicContact CG-CD2 3.75Å; E56-S108 WeakPolarHBondContact OE1-CB 3.29Å; E56-S108 PolarHBondContact OE1-OG 2.91Å; E56-S108 PolarHBondContact OE2-OG 3.44Å; E56-L109 HydrophobicContact CB-CD2 3.79Å; E56-L109 HydrophobicContact CB-CG 4.25Å; E56-R112 VanDerWaalsContact OE2-CD 3.28Å; E56-R112 WeakPolarHBondContact OE2-CD 3.37Å; E56-R112 IonicContact OE2-CZ 2.79Å; E56-R112 IonicContact OE2-NE 2.68Å; E56-R112 IonicContact OE2-NH1 3.44Å; E56-R112 PolarHBondContact OE2-NH1 2.69Å
57	E	90.1	Very high	93	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-48.5	178.6	-68.9	-176.7	107.8	0	0	111.7	L11 Y12 L13 S14 L20 D55 Y60 V61 L109 Y113	L11-E57 WeakPolarHBondContact CA-OE2 3.38Å; L11-E57 HydrophobicContact CD2-CG 3.77Å; Y12-E57 VanDerWaalsContact CD1-OE2 3.31Å; Y12-E57 WeakPolarHBondContact CD1-OE2 3.36Å; Y12-E57 PolarHBondContact N-OE2 3.16Å; L13-E57 HydrophobicContact CB-CB 3.91Å; L13-E57 HydrophobicContact CB-CG 4.39Å; L13-E57 WeakPolarHBondContact CB-OE2 3.14Å; L13-E57 HydrophobicContact CD2-CB 4.18Å; L13-E57 PolarHBondContact N-OE1 2.77Å; L13-E57 PolarHBondContact N-OE2 3.05Å; S14-E57 PolarHBondContact N-OE1 3.38Å; L20-E57 HydrophobicContact CD1-CB 4.3Å; L20-E57 HydrophobicContact CD2-CB 4.42Å; L20-E57 HydrophobicContact CD2-CG 4.49Å; D55-E57 PolarHBondContact O-N 2.74Å; E57-Y60 PolarHBondContact O-N 3.42Å; E57-V61 WeakPolarHBondContact O-CG2 3.32Å; E57-V61 PolarHBondContact O-N 3.11Å; E57-L109 HydrophobicContact CG-CD2 3.67Å; E57-Y113 PolarHBondContact OE1-OH 3.48Å
58	R	91.8	Very high	92.9	Very high	99 Å²	99	42.7 Å²	42.7	37%	0.374	20%	0.199	S	C	.	.	H	α-helix	trans	-72.9	-34.8	-178.6	-157.7	170.7	83	105.7	0.9	111.4	L13 C50 D55 L62	L13-R58 HydrophobicContact CD2-CB 4.44Å; C50-R58 HydrophobicContact CB-CB 4.49Å; C50-R58 PolarHBondContact SG-NE 3.31Å; C50-R58 PolarHBondContact SG-NH2 3.11Å; D55-R58 HydrophobicContact CB-CB 4.42Å; D55-R58 PolarHBondContact O-N 2.9Å; D55-R58 WeakPolarHBondContact OD1-CB 3.3Å; D55-R58 PolarHBondContact OD1-N 3.28Å; R58-L62 HydrophobicContact CG-CD1 4.23Å; R58-L62 WeakPolarHBondContact O-CB 3.48Å; R58-L62 WeakPolarHBondContact O-CD1 3.03Å; R58-L62 WeakPolarHBondContact O-CG 3.3Å; R58-L62 PolarHBondContact O-N 3.17Å; R58-L62 VanDerWaalsContact O-N 3.09Å
59	A	94.4	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-51.2	171	0	0	0	0	0	111.1	C50 R51 D55 V61 L62 Y63 L105	C50-A59 HydrophobicContact CB-CB 3.71Å; R51-A59 HydrophobicContact CB-CB 4.32Å; D55-A59 WeakPolarHBondContact O-CB 3.45Å; D55-A59 PolarHBondContact O-N 3.46Å; A59-V61 PolarHBondContact O-N 3.2Å; A59-L62 PolarHBondContact O-N 2.96Å; A59-L62 VanDerWaalsContact O-N 3.16Å; A59-Y63 HydrophobicContact CB-CD2 4.35Å; A59-Y63 HydrophobicContact CB-CE2 4.16Å; A59-Y63 WeakPolarHBondContact O-CD2 3.49Å; A59-Y63 PolarHBondContact O-N 3.01Å; A59-L105 HydrophobicContact CB-CD1 3.75Å
60	Y	94.9	Very high	92.7	Very high	6 Å²	6	39.6 Å²	39.6	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-57.6	-49.6	178.5	177.4	-101.9	0	0	0	111.9	L17 L20 N21 E56 E57 L62 Y63 M64 A102 L105 L109	L17-Y60 HydrophobicContact CD1-CD1 4.24Å; L17-Y60 HydrophobicContact CD1-CE1 3.64Å; L20-Y60 HydrophobicContact CD2-CD1 3.53Å; L20-Y60 HydrophobicContact CD2-CE1 4.14Å; L20-Y60 HydrophobicContact CD2-CG 4.39Å; L20-Y60 HydrophobicContact CG-CD1 4.11Å; N21-Y60 WeakPolarHBondContact OD1-CE1 3.4Å; N21-Y60 PolarHBondContact OD1-OH 2.89Å; N21-Y60 VanDerWaalsContact OD1-OH 3.04Å; E56-Y60 VanDerWaalsContact O-CB 3.26Å; E56-Y60 WeakPolarHBondContact O-CB 3.38Å; E56-Y60 PolarHBondContact O-N 3.44Å; E57-Y60 PolarHBondContact O-N 3.42Å; Y60-L62 PolarHBondContact O-N 2.88Å; Y60-Y63 PolarHBondContact O-N 3.26Å; Y60-M64 HydrophobicContact CE2-CE 4.05Å; Y60-M64 VanDerWaalsContact O-CB 3.29Å; Y60-M64 WeakPolarHBondContact O-CB 3.27Å; Y60-M64 PolarHBondContact O-N 3.1Å; Y60-A102 WeakPolarHBondContact CD2-O 3.4Å; Y60-A102 VanDerWaalsContact CE2-O 3.26Å; Y60-A102 WeakPolarHBondContact CE2-O 3.32Å; Y60-L105 HydrophobicContact CD2-CB 3.9Å; Y60-L105 HydrophobicContact CG-CB 4.42Å; Y60-L109 HydrophobicContact CD1-CD1 4.2Å; Y60-L109 HydrophobicContact CG-CD1 3.85Å
61	V	93.7	Very high	92.7	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.097	20%	0.198	C	C	.	.	H	α-helix	trans	-57.4	-40	178.4	168.3	0	0	0	0	111.2	L13 L20 K23 T24 E57 A59 K65	L13-V61 HydrophobicContact CD2-CG2 4.15Å; L20-V61 HydrophobicContact CD1-CG2 3.41Å; L20-V61 VanDerWaalsContact CD1-CG2 3.41Å; L20-V61 HydrophobicContact CD2-CG2 4.29Å; L20-V61 HydrophobicContact CG-CG2 3.55Å; K23-V61 HydrophobicContact CB-CG1 4.42Å; T24-V61 HydrophobicContact CG2-CB 4.49Å; T24-V61 HydrophobicContact CG2-CG1 4.34Å; T24-V61 HydrophobicContact CG2-CG2 4.45Å; E57-V61 WeakPolarHBondContact O-CG2 3.32Å; E57-V61 PolarHBondContact O-N 3.11Å; A59-V61 PolarHBondContact O-N 3.2Å; V61-K65 WeakPolarHBondContact O-CB 3.24Å; V61-K65 PolarHBondContact O-N 3.33Å
62	L	94.4	Very high	92.6	Very high	27 Å²	27	40.9 Å²	40.9	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-74.5	-42.5	-179.7	-67.4	167.9	0	0	0	112.6	I43 T46 A47 R58 A59 Y60 K65 Y66	I43-L62 HydrophobicContact CG2-CB 4.12Å; I43-L62 HydrophobicContact CG2-CD2 4.05Å; I43-L62 WeakPolarHBondContact CG2-O 3.23Å; T46-L62 HydrophobicContact CG2-CD1 3.77Å; A47-L62 HydrophobicContact CB-CB 3.63Å; R58-L62 HydrophobicContact CG-CD1 4.23Å; R58-L62 WeakPolarHBondContact O-CB 3.48Å; R58-L62 WeakPolarHBondContact O-CD1 3.03Å; R58-L62 WeakPolarHBondContact O-CG 3.3Å; R58-L62 PolarHBondContact O-N 3.17Å; R58-L62 VanDerWaalsContact O-N 3.09Å; A59-L62 PolarHBondContact O-N 2.96Å; A59-L62 VanDerWaalsContact O-N 3.16Å; Y60-L62 PolarHBondContact O-N 2.88Å; L62-K65 PolarHBondContact O-N 3.24Å; L62-Y66 WeakPolarHBondContact O-CB 3.32Å; L62-Y66 PolarHBondContact O-N 2.76Å
63	Y	95.8	Very high	92.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-46.9	174.5	-72	-60.6	0	0	0	111.9	F44 A47 E48 R51 A59 Y60 K65 Y66 V67 A98 E101 L105	F44-Y63 HydrophobicContact CD2-CD1 4.38Å; F44-Y63 HydrophobicContact CD2-CE1 4.17Å; F44-Y63 HydrophobicContact CE2-CD1 4.38Å; F44-Y63 AromaticContact CE2-CE1 3.94Å; F44-Y63 HydrophobicContact CE2-CE1 3.94Å; A47-Y63 HydrophobicContact CB-CD1 3.61Å; A47-Y63 HydrophobicContact CB-CD2 3.97Å; A47-Y63 HydrophobicContact CB-CE1 3.5Å; A47-Y63 HydrophobicContact CB-CE2 3.86Å; A47-Y63 HydrophobicContact CB-CG 3.85Å; E48-Y63 PolarHBondContact OE1-OH 2.68Å; R51-Y63 HydrophobicContact CB-CE2 4.25Å; R51-Y63 WeakPolarHBondContact CD-OH 3.38Å; R51-Y63 PolarHBondContact NE-OH 3.25Å; A59-Y63 HydrophobicContact CB-CD2 4.35Å; A59-Y63 HydrophobicContact CB-CE2 4.16Å; A59-Y63 WeakPolarHBondContact O-CD2 3.49Å; A59-Y63 PolarHBondContact O-N 3.01Å; Y60-Y63 PolarHBondContact O-N 3.26Å; Y63-K65 VanDerWaalsContact C-N 3.31Å; Y63-K65 PolarHBondContact O-N 2.85Å; Y63-Y66 WeakPolarHBondContact O-CB 3.39Å; Y63-Y66 PolarHBondContact O-N 2.67Å; Y63-Y66 VanDerWaalsContact O-N 3.16Å; Y63-V67 WeakPolarHBondContact O-CG2 3.46Å; Y63-V67 PolarHBondContact O-N 3.42Å; Y63-A98 HydrophobicContact CD1-CB 4.01Å; Y63-E101 HydrophobicContact CD1-CB 4.41Å; Y63-E101 HydrophobicContact CD2-CB 3.89Å; Y63-E101 HydrophobicContact CE1-CB 4.3Å; Y63-E101 HydrophobicContact CE2-CB 3.78Å; Y63-E101 HydrophobicContact CE2-CG 4.35Å; Y63-E101 HydrophobicContact CG-CB 4.23Å; Y63-L105 HydrophobicContact CD2-CD1 3.85Å; Y63-L105 HydrophobicContact CE2-CD1 4.09Å
64	M	94.1	Very high	92.6	Very high	43 Å²	43	33.8 Å²	33.8	21%	0.212	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-36.7	177.3	-173.4	58.8	75.4	0	0	111.8	T24 Y60 V67 T68 A102	T24-M64 HydrophobicContact CG2-CB 3.78Å; T24-M64 HydrophobicContact CG2-CG 3.74Å; Y60-M64 HydrophobicContact CE2-CE 4.05Å; Y60-M64 VanDerWaalsContact O-CB 3.29Å; Y60-M64 WeakPolarHBondContact O-CB 3.27Å; Y60-M64 PolarHBondContact O-N 3.1Å; M64-V67 PolarHBondContact O-N 3.07Å; M64-T68 WeakPolarHBondContact O-CB 3.35Å; M64-T68 PolarHBondContact O-N 2.9Å; M64-T68 PolarHBondContact O-OG1 3Å; M64-A102 HydrophobicContact CE-CB 4.29Å
65	K	93.2	Very high	92.7	Very high	65 Å²	65	34.3 Å²	34.3	28%	0.283	16%	0.159	S	C	.	.	H	α-helix	trans	-67.5	-38	173.2	-172.2	167	-168.5	151.5	0	112.5	V26 I43 V61 L62 Y63 T68 V69	V26-K65 HydrophobicContact CG1-CD 4.33Å; V26-K65 HydrophobicContact CG1-CG 3.92Å; I43-K65 HydrophobicContact CD1-CG 4.37Å; V61-K65 WeakPolarHBondContact O-CB 3.24Å; V61-K65 PolarHBondContact O-N 3.33Å; L62-K65 PolarHBondContact O-N 3.24Å; Y63-K65 VanDerWaalsContact C-N 3.31Å; Y63-K65 PolarHBondContact O-N 2.85Å; K65-T68 PolarHBondContact O-N 3.21Å; K65-V69 WeakPolarHBondContact O-CG2 3.42Å; K65-V69 PolarHBondContact O-N 2.76Å
66	Y	94.9	Very high	92.6	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-60.1	-50.4	171.6	175.3	-84.6	0	0	0	111.2	A40 F44 L62 Y63 T68 V69 Y70 L90 I95 A98	A40-Y66 HydrophobicContact CB-CD2 3.82Å; A40-Y66 HydrophobicContact CB-CE2 3.79Å; A40-Y66 VanDerWaalsContact O-CD2 3.24Å; A40-Y66 WeakPolarHBondContact O-CD2 3.28Å; F44-Y66 HydrophobicContact CB-CD2 3.69Å; F44-Y66 HydrophobicContact CB-CE2 3.73Å; F44-Y66 HydrophobicContact CD2-CD2 4.31Å; F44-Y66 HydrophobicContact CD2-CE2 4.24Å; F44-Y66 HydrophobicContact CD2-CG 4.49Å; F44-Y66 HydrophobicContact CG-CD2 4.43Å; F44-Y66 HydrophobicContact CG-CE2 4.25Å; L62-Y66 WeakPolarHBondContact O-CB 3.32Å; L62-Y66 PolarHBondContact O-N 2.76Å; Y63-Y66 WeakPolarHBondContact O-CB 3.39Å; Y63-Y66 PolarHBondContact O-N 2.67Å; Y63-Y66 VanDerWaalsContact O-N 3.16Å; Y66-T68 VanDerWaalsContact C-N 3.28Å; Y66-T68 PolarHBondContact O-N 2.85Å; Y66-V69 PolarHBondContact O-N 3.34Å; Y66-Y70 PolarHBondContact O-N 2.92Å; Y66-L90 HydrophobicContact CE2-CD2 4.37Å; Y66-I95 HydrophobicContact CE1-CG1 4.19Å; Y66-I95 WeakPolarHBondContact OH-CG1 2.94Å; Y66-A98 HydrophobicContact CD1-CB 3.49Å; Y66-A98 VanDerWaalsContact CD1-CB 3.49Å; Y66-A98 HydrophobicContact CE1-CB 3.83Å; Y66-A98 HydrophobicContact CG-CB 4.34Å
67	V	94.2	Very high	92.6	Very high	20 Å²	20	41 Å²	41	12%	0.121	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-38.7	177.9	172	0	0	0	0	110.8	Y63 M64 Y70 N71 A98 V99	Y63-V67 WeakPolarHBondContact O-CG2 3.46Å; Y63-V67 PolarHBondContact O-N 3.42Å; M64-V67 PolarHBondContact O-N 3.07Å; V67-Y70 PolarHBondContact O-N 3.38Å; V67-N71 VanDerWaalsContact O-CB 3.26Å; V67-N71 WeakPolarHBondContact O-CB 3.47Å; V67-N71 PolarHBondContact O-N 2.91Å; V67-N71 PolarHBondContact O-ND2 3.48Å; V67-A98 HydrophobicContact CG2-CB 4.01Å; V67-V99 HydrophobicContact CG1-CG2 4.34Å; V67-V99 HydrophobicContact CG2-CG2 3.8Å
68	T	92.5	Very high	92.6	Very high	43 Å²	43	44 Å²	44	26%	0.264	21%	0.213	S	C	.	.	H	α-helix	trans	-66.7	-43.8	176	-54.2	0	0	0	0	112.1	V26 M64 K65 Y66 N71 L72	V26-T68 HydrophobicContact CG2-CG2 3.67Å; M64-T68 WeakPolarHBondContact O-CB 3.35Å; M64-T68 PolarHBondContact O-N 2.9Å; M64-T68 PolarHBondContact O-OG1 3Å; K65-T68 PolarHBondContact O-N 3.21Å; Y66-T68 VanDerWaalsContact C-N 3.28Å; Y66-T68 PolarHBondContact O-N 2.85Å; T68-N71 PolarHBondContact O-N 2.87Å; T68-L72 WeakPolarHBondContact O-CB 3.4Å; T68-L72 PolarHBondContact O-N 3.09Å
69	V	91.8	Very high	92.6	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-44.3	173.6	169.2	0	0	0	0	111.1	V26 Y36 A40 K65 Y66 N71 L72 I73	V26-V69 HydrophobicContact CB-CG2 4.45Å; V26-V69 HydrophobicContact CG1-CG2 4Å; V26-V69 HydrophobicContact CG2-CG2 4Å; Y36-V69 HydrophobicContact CD1-CG1 3.83Å; Y36-V69 HydrophobicContact CD1-CG2 4.44Å; Y36-V69 HydrophobicContact CG-CG1 4.34Å; A40-V69 HydrophobicContact CB-CG1 4.12Å; K65-V69 WeakPolarHBondContact O-CG2 3.42Å; K65-V69 PolarHBondContact O-N 2.76Å; Y66-V69 PolarHBondContact O-N 3.34Å; V69-N71 PolarHBondContact O-N 3.25Å; V69-L72 WeakPolarHBondContact O-CB 3.44Å; V69-L72 PolarHBondContact O-N 3.14Å; V69-I73 WeakPolarHBondContact O-CG1 3.38Å; V69-I73 PolarHBondContact O-N 3.49Å
70	Y	92.7	Very high	92.5	Very high	37 Å²	37	45.3 Å²	45.3	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-44.9	175.3	178.4	-115.5	0	0	0	111.9	Y66 V67 L72 I73 K74 F79 H87 L90 I95	Y66-Y70 PolarHBondContact O-N 2.92Å; V67-Y70 PolarHBondContact O-N 3.38Å; Y70-L72 PolarHBondContact O-N 2.93Å; Y70-I73 WeakPolarHBondContact O-CG1 3.4Å; Y70-I73 PolarHBondContact O-N 2.76Å; Y70-K74 HydrophobicContact CD1-CD 4.09Å; Y70-K74 HydrophobicContact CE1-CD 3.77Å; Y70-K74 HydrophobicContact CE2-CB 4.36Å; Y70-K74 WeakPolarHBondContact O-CB 3.35Å; Y70-K74 WeakPolarHBondContact O-CG 3.18Å; Y70-K74 PolarHBondContact O-N 2.99Å; Y70-F79 AromaticContact CE2-CZ 3.93Å; Y70-F79 HydrophobicContact CE2-CZ 3.93Å; Y70-H87 AromaticContact CE2-NE2 3.97Å; Y70-H87 AromaticContact CZ-NE2 3.91Å; Y70-H87 PolarHBondContact OH-NE2 2.88Å; Y70-L90 HydrophobicContact CD2-CD1 4Å; Y70-L90 HydrophobicContact CE2-CD1 4.29Å; Y70-I95 HydrophobicContact CD1-CG2 3.84Å; Y70-I95 HydrophobicContact CD2-CD1 4.29Å; Y70-I95 HydrophobicContact CE1-CG2 3.61Å; Y70-I95 HydrophobicContact CE2-CD1 3.82Å; Y70-I95 HydrophobicContact CG-CG2 4.43Å
71	N	92.2	Very high	92.4	Very high	58 Å²	58	53.1 Å²	53.1	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-23.5	176.6	-75	-25	0	0	0	113.8	V67 T68 V69 K74 K75	V67-N71 VanDerWaalsContact O-CB 3.26Å; V67-N71 WeakPolarHBondContact O-CB 3.47Å; V67-N71 PolarHBondContact O-N 2.91Å; V67-N71 PolarHBondContact O-ND2 3.48Å; T68-N71 PolarHBondContact O-N 2.87Å; V69-N71 PolarHBondContact O-N 3.25Å; N71-K74 VanDerWaalsContact OD1-CE 3.23Å; N71-K74 WeakPolarHBondContact OD1-CE 3.42Å; N71-K74 PolarHBondContact OD1-NZ 2.82Å; N71-K75 WeakPolarHBondContact O-CD 3.49Å; N71-K75 WeakPolarHBondContact O-CE 3.46Å; N71-K75 WeakPolarHBondContact O-CG 3.37Å
72	L	90.8	Very high	92.4	Very high	30 Å²	30	56.7 Å²	56.7	16%	0.157	27%	0.274	C	S	.	.	H	α-helix	trans	-79.7	-50.5	172.7	-178.2	154.4	0	0	0	111.3	V26 P28 Y36 T68 V69 Y70	V26-L72 HydrophobicContact CG2-CD1 4.42Å; P28-L72 HydrophobicContact CB-CD1 4.1Å; P28-L72 HydrophobicContact CG-CD1 3.97Å; Y36-L72 HydrophobicContact CD2-CD2 4.25Å; Y36-L72 HydrophobicContact CE2-CD2 3.88Å; T68-L72 WeakPolarHBondContact O-CB 3.4Å; T68-L72 PolarHBondContact O-N 3.09Å; V69-L72 WeakPolarHBondContact O-CB 3.44Å; V69-L72 PolarHBondContact O-N 3.14Å; Y70-L72 PolarHBondContact O-N 2.93Å
73	I	90.4	Very high	92.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.9	-36.8	-177.1	62.1	-177	0	0	0	113.2	T33 Y36 V37 V69 Y70 K75 R76 F79 L90	T33-I73 HydrophobicContact CG2-CB 4.17Å; T33-I73 HydrophobicContact CG2-CG2 4.28Å; Y36-I73 VanDerWaalsContact CB-CG2 3.49Å; Y36-I73 HydrophobicContact CD2-CG2 4.01Å; Y36-I73 HydrophobicContact CG-CG2 3.89Å; V37-I73 HydrophobicContact CG2-CD1 3.66Å; V69-I73 WeakPolarHBondContact O-CG1 3.38Å; V69-I73 PolarHBondContact O-N 3.49Å; Y70-I73 WeakPolarHBondContact O-CG1 3.4Å; Y70-I73 PolarHBondContact O-N 2.76Å; I73-K75 PolarHBondContact O-N 3.35Å; I73-R76 WeakPolarHBondContact O-CB 3.48Å; I73-R76 PolarHBondContact O-N 2.73Å; I73-F79 HydrophobicContact CB-CD2 3.94Å; I73-F79 HydrophobicContact CB-CE2 4.42Å; I73-F79 HydrophobicContact CD1-CD2 3.95Å; I73-F79 HydrophobicContact CD1-CE2 3.64Å; I73-F79 HydrophobicContact CG1-CD2 3.79Å; I73-F79 HydrophobicContact CG1-CE2 3.76Å; I73-F79 WeakPolarHBondContact O-CB 3.41Å; I73-F79 WeakPolarHBondContact O-CG 3.31Å; I73-L90 HydrophobicContact CD1-CD1 4.33Å
74	K	91.3	Very high	92	Very high	82 Å²	82	65.3 Å²	65.3	36%	0.357	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.4	-178.6	80.9	-172.3	-166.1	-173.6	0	114.6	Y70 N71 F79	Y70-K74 HydrophobicContact CD1-CD 4.09Å; Y70-K74 HydrophobicContact CE1-CD 3.77Å; Y70-K74 HydrophobicContact CE2-CB 4.36Å; Y70-K74 WeakPolarHBondContact O-CB 3.35Å; Y70-K74 WeakPolarHBondContact O-CG 3.18Å; Y70-K74 PolarHBondContact O-N 2.99Å; N71-K74 VanDerWaalsContact OD1-CE 3.23Å; N71-K74 WeakPolarHBondContact OD1-CE 3.42Å; N71-K74 PolarHBondContact OD1-NZ 2.82Å; K74-F79 HydrophobicContact CB-CD1 4.25Å; K74-F79 HydrophobicContact CB-CE1 4.11Å
75	K	91.2	Very high	92	Very high	161 Å²	161	68.7 Å²	68.7	70%	0.7	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-17.9	174.7	-65.8	179.2	-178.5	-176.6	0	113.2	N71 I73	N71-K75 WeakPolarHBondContact O-CD 3.49Å; N71-K75 WeakPolarHBondContact O-CE 3.46Å; N71-K75 WeakPolarHBondContact O-CG 3.37Å; I73-K75 PolarHBondContact O-N 3.35Å
76	R	89.8	Confident	92	Very high	59 Å²	59	65.8 Å²	65.8	22%	0.223	32%	0.316	C	S	.	.	S	Bend	trans	-77.9	147	-176.2	-62.4	-178.6	164.1	-169.5	-6.6	111.9	I31 T33 I73 D78 F79 K80	I31-R76 PolarHBondContact O-NH1 2.74Å; I31-R76 PolarHBondContact O-NH2 3.33Å; T33-R76 WeakPolarHBondContact OG1-CD 3.28Å; T33-R76 PolarHBondContact OG1-NH1 3.19Å; I73-R76 WeakPolarHBondContact O-CB 3.48Å; I73-R76 PolarHBondContact O-N 2.73Å; R76-D78 WeakPolarHBondContact CB-OD1 3.42Å; R76-D78 PolarHBondContact O-N 2.94Å; R76-F79 HydrophobicContact CB-CB 4.47Å; R76-F79 PolarHBondContact O-N 3.14Å; R76-K80 PolarHBondContact O-N 2.72Å
77	P	90.7	Very high	91.9	Very high	106 Å²	106	67.7 Å²	67.7	69%	0.688	33%	0.325	S	S	*	.	H	α-helix	trans	-64.2	-37.8	179.6	-23	34.4	0	0	0	114	F79 K80 Q81	P77-F79 PolarHBondContact O-N 3.12Å; P77-K80 WeakPolarHBondContact O-CB 3.49Å; P77-K80 PolarHBondContact O-N 2.93Å; P77-Q81 PolarHBondContact O-N 3.49Å
78	D	90.3	Very high	91.9	Very high	68 Å²	68	71.2 Å²	71.2	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-37.1	179.2	65.3	-27.6	0	0	0	112.3	T33 R76 Q81 Q82	T33-D78 WeakPolarHBondContact CB-OD2 3.28Å; T33-D78 VanDerWaalsContact OG1-CG 3.24Å; T33-D78 PolarHBondContact OG1-OD1 3.47Å; T33-D78 VanDerWaalsContact OG1-OD1 3.12Å; T33-D78 PolarHBondContact OG1-OD2 3.09Å; R76-D78 WeakPolarHBondContact CB-OD1 3.42Å; R76-D78 PolarHBondContact O-N 2.94Å; D78-Q81 PolarHBondContact O-N 3Å; D78-Q82 PolarHBondContact O-N 3.41Å
79	F	91.9	Very high	91.8	Very high	1 Å²	1	72.6 Å²	72.6	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-43.6	170.9	-169.5	-81.4	0	0	0	111.6	T33 Y70 I73 K74 R76 P77 Q82 Q83 F86 L90	T33-F79 HydrophobicContact CG2-CB 4.09Å; T33-F79 HydrophobicContact CG2-CD2 3.92Å; Y70-F79 AromaticContact CE2-CZ 3.93Å; Y70-F79 HydrophobicContact CE2-CZ 3.93Å; I73-F79 HydrophobicContact CB-CD2 3.94Å; I73-F79 HydrophobicContact CB-CE2 4.42Å; I73-F79 HydrophobicContact CD1-CD2 3.95Å; I73-F79 HydrophobicContact CD1-CE2 3.64Å; I73-F79 HydrophobicContact CG1-CD2 3.79Å; I73-F79 HydrophobicContact CG1-CE2 3.76Å; I73-F79 WeakPolarHBondContact O-CB 3.41Å; I73-F79 WeakPolarHBondContact O-CG 3.31Å; K74-F79 HydrophobicContact CB-CD1 4.25Å; K74-F79 HydrophobicContact CB-CE1 4.11Å; R76-F79 HydrophobicContact CB-CB 4.47Å; R76-F79 PolarHBondContact O-N 3.14Å; P77-F79 PolarHBondContact O-N 3.12Å; F79-Q82 CarbonylContact O-C 3.35Å; F79-Q82 PolarHBondContact O-N 3.35Å; F79-Q83 HydrophobicContact CE1-CG 4.15Å; F79-Q83 WeakPolarHBondContact O-CA 3.27Å; F79-Q83 PolarHBondContact O-N 3.3Å; F79-F86 HydrophobicContact CB-CD2 4.45Å; F79-F86 HydrophobicContact CD2-CB 3.99Å; F79-F86 AromaticContact CD2-CD2 3.69Å; F79-F86 HydrophobicContact CD2-CD2 3.69Å; F79-F86 HydrophobicContact CD2-CE2 4.38Å; F79-F86 AromaticContact CD2-CG 3.94Å; F79-F86 HydrophobicContact CD2-CG 3.94Å; F79-F86 HydrophobicContact CE2-CB 3.43Å; F79-F86 VanDerWaalsContact CE2-CB 3.43Å; F79-F86 HydrophobicContact CE2-CD2 4.06Å; F79-F86 AromaticContact CE2-CG 3.88Å; F79-F86 HydrophobicContact CE2-CG 3.88Å; F79-F86 HydrophobicContact CG-CD2 4.09Å; F79-F86 HydrophobicContact CZ-CB 3.76Å; F79-L90 HydrophobicContact CE2-CD1 4.37Å
80	K	92	Very high	91.8	Very high	126 Å²	126	72.5 Å²	72.5	55%	0.548	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-37	179.2	-71.4	176.5	171.5	-66.4	0	112.5	R76 P77 Q82	R76-K80 PolarHBondContact O-N 2.72Å; P77-K80 WeakPolarHBondContact O-CB 3.49Å; P77-K80 PolarHBondContact O-N 2.93Å; K80-Q82 VanDerWaalsContact C-N 3.31Å; K80-Q82 PolarHBondContact O-N 3Å
81	Q	93.1	Very high	91.8	Very high	169 Å²	169	71.5 Å²	71.5	79%	0.79	36%	0.356	S	S	*	.	H	α-helix	trans	-67.9	-28.2	178	-169.2	178.8	16.4	0	0	113.2	P77 D78	P77-Q81 PolarHBondContact O-N 3.49Å; D78-Q81 PolarHBondContact O-N 3Å
82	Q	92.8	Very high	91.7	Very high	92 Å²	92	73 Å²	73	43%	0.43	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	38.9	178.4	-54.3	-155.7	-84.5	0	0	112.2	D78 F79 K80 D84 Y85 F86	D78-Q82 PolarHBondContact O-N 3.41Å; F79-Q82 CarbonylContact O-C 3.35Å; F79-Q82 PolarHBondContact O-N 3.35Å; K80-Q82 VanDerWaalsContact C-N 3.31Å; K80-Q82 PolarHBondContact O-N 3Å; Q82-D84 PolarHBondContact O-N 3.45Å; Q82-Y85 WeakPolarHBondContact O-CB 3.22Å; Q82-Y85 PolarHBondContact O-N 3.03Å; Q82-F86 HydrophobicContact CB-CD2 4.07Å; Q82-F86 HydrophobicContact CB-CE2 3.81Å; Q82-F86 VanDerWaalsContact O-CD2 3.22Å; Q82-F86 WeakPolarHBondContact O-CD2 3.36Å; Q82-F86 PolarHBondContact O-N 3.47Å; Q82-F86 VanDerWaalsContact O-N 3.08Å
83	Q	91.6	Very high	91.8	Very high	81 Å²	81	74 Å²	74	38%	0.379	39%	0.387	S	S	.	.	H	α-helix	trans	-57.6	-49.4	-169.8	-172.9	178	-83.3	0	0	112.4	F79 Y85 F86 H87	F79-Q83 HydrophobicContact CE1-CG 4.15Å; F79-Q83 WeakPolarHBondContact O-CA 3.27Å; F79-Q83 PolarHBondContact O-N 3.3Å; Q83-Y85 VanDerWaalsContact C-N 3.3Å; Q83-Y85 PolarHBondContact O-N 3.15Å; Q83-F86 PolarHBondContact O-N 3.5Å; Q83-F86 VanDerWaalsContact O-N 3.13Å; Q83-H87 WeakPolarHBondContact O-CB 3.45Å; Q83-H87 PolarHBondContact O-N 2.97Å
84	D	91.6	Very high	92	Very high	127 Å²	127	76.9 Å²	76.9	68%	0.679	40%	0.402	S	S	*	.	H	α-helix	trans	-66.7	-33.2	-175.8	-50.8	-45.8	0	0	0	112.2	Q82 S88	Q82-D84 PolarHBondContact O-N 3.45Å; D84-S88 VanDerWaalsContact O-CB 3.24Å; D84-S88 WeakPolarHBondContact O-CB 3.48Å; D84-S88 PolarHBondContact O-N 2.91Å
85	Y	93.7	Very high	92.1	Very high	114 Å²	114	74 Å²	74	45%	0.447	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-47.4	171.6	170.3	-101.7	0	0	0	111.2	Q82 Q83 S88 I89	Q82-Y85 WeakPolarHBondContact O-CB 3.22Å; Q82-Y85 PolarHBondContact O-N 3.03Å; Q83-Y85 VanDerWaalsContact C-N 3.3Å; Q83-Y85 PolarHBondContact O-N 3.15Å; Y85-S88 WeakPolarHBondContact O-CB 3.43Å; Y85-S88 PolarHBondContact O-N 3.21Å; Y85-I89 HydrophobicContact CD2-CG1 4.47Å; Y85-I89 HydrophobicContact CE1-CG1 4.45Å; Y85-I89 HydrophobicContact CE2-CD1 4.4Å; Y85-I89 HydrophobicContact CE2-CG1 4.09Å; Y85-I89 WeakPolarHBondContact O-CG1 3.47Å; Y85-I89 PolarHBondContact O-N 3.4Å
86	F	92.3	Very high	92.3	Very high	4 Å²	4	72.5 Å²	72.5	2%	0.018	38%	0.384	C	S	.	.	H	α-helix	trans	-70.4	-31.6	178.3	-67.3	-55.3	0	0	0	113.1	T33 K34 V37 F79 Q82 Q83 L90	T33-F86 HydrophobicContact CG2-CE2 4.21Å; T33-F86 HydrophobicContact CG2-CZ 4.13Å; K34-F86 HydrophobicContact CG-CE1 4.04Å; K34-F86 HydrophobicContact CG-CZ 4.19Å; V37-F86 HydrophobicContact CG1-CD1 4.5Å; V37-F86 HydrophobicContact CG2-CD1 3.76Å; V37-F86 HydrophobicContact CG2-CE1 4.23Å; V37-F86 HydrophobicContact CG2-CG 4.41Å; F79-F86 HydrophobicContact CB-CD2 4.45Å; F79-F86 HydrophobicContact CD2-CB 3.99Å; F79-F86 AromaticContact CD2-CD2 3.69Å; F79-F86 HydrophobicContact CD2-CD2 3.69Å; F79-F86 HydrophobicContact CD2-CE2 4.38Å; F79-F86 AromaticContact CD2-CG 3.94Å; F79-F86 HydrophobicContact CD2-CG 3.94Å; F79-F86 HydrophobicContact CE2-CB 3.43Å; F79-F86 VanDerWaalsContact CE2-CB 3.43Å; F79-F86 HydrophobicContact CE2-CD2 4.06Å; F79-F86 AromaticContact CE2-CG 3.88Å; F79-F86 HydrophobicContact CE2-CG 3.88Å; F79-F86 HydrophobicContact CG-CD2 4.09Å; F79-F86 HydrophobicContact CZ-CB 3.76Å; Q82-F86 HydrophobicContact CB-CD2 4.07Å; Q82-F86 HydrophobicContact CB-CE2 3.81Å; Q82-F86 VanDerWaalsContact O-CD2 3.22Å; Q82-F86 WeakPolarHBondContact O-CD2 3.36Å; Q82-F86 PolarHBondContact O-N 3.47Å; Q82-F86 VanDerWaalsContact O-N 3.08Å; Q83-F86 PolarHBondContact O-N 3.5Å; Q83-F86 VanDerWaalsContact O-N 3.13Å; F86-L90 VanDerWaalsContact O-CB 3.3Å; F86-L90 WeakPolarHBondContact O-CB 3.21Å; F86-L90 VanDerWaalsContact O-CG 3.29Å; F86-L90 WeakPolarHBondContact O-CG 3.44Å; F86-L90 PolarHBondContact O-N 3.19Å
87	H	92.4	Very high	92.6	Very high	41 Å²	41	72.7 Å²	72.7	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-69.3	-39.4	171.4	-75.5	172.6	0	0	0	112.3	Y70 Q83 L90 G91 P92	Y70-H87 AromaticContact CE2-NE2 3.97Å; Y70-H87 AromaticContact CZ-NE2 3.91Å; Y70-H87 PolarHBondContact OH-NE2 2.88Å; Q83-H87 WeakPolarHBondContact O-CB 3.45Å; Q83-H87 PolarHBondContact O-N 2.97Å; H87-L90 PolarHBondContact O-N 3.16Å; H87-G91 WeakPolarHBondContact O-CA 3.33Å; H87-G91 PolarHBondContact O-N 3.3Å; H87-P92 WeakPolarHBondContact O-CD 3.4Å
88	S	94.1	Very high	92.8	Very high	94 Å²	94	67.6 Å²	67.6	66%	0.657	35%	0.353	S	S	*	.	H	α-helix	trans	-58.4	-45.7	171.4	174.8	0	0	0	0	111.7	D84 Y85	D84-S88 VanDerWaalsContact O-CB 3.24Å; D84-S88 WeakPolarHBondContact O-CB 3.48Å; D84-S88 PolarHBondContact O-N 2.91Å; Y85-S88 WeakPolarHBondContact O-CB 3.43Å; Y85-S88 PolarHBondContact O-N 3.21Å
89	I	92	Very high	93.1	Very high	72 Å²	72	68 Å²	68	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-70.8	-40.8	179.6	-65	-64.7	0	0	0	112.6	V37 L41 Y85	V37-I89 HydrophobicContact CG1-CB 4.43Å; V37-I89 HydrophobicContact CG1-CG2 3.61Å; L41-I89 HydrophobicContact CD1-CG2 3.91Å; Y85-I89 HydrophobicContact CD2-CG1 4.47Å; Y85-I89 HydrophobicContact CE1-CG1 4.45Å; Y85-I89 HydrophobicContact CE2-CD1 4.4Å; Y85-I89 HydrophobicContact CE2-CG1 4.09Å; Y85-I89 WeakPolarHBondContact O-CG1 3.47Å; Y85-I89 PolarHBondContact O-N 3.4Å
90	L	91.4	Very high	93.3	Very high	1 Å²	1	72.5 Å²	72.5	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-77.3	-30.5	-179.7	-72.4	169.9	0	0	0	113.3	V37 A40 Y66 Y70 I73 F79 F86 H87 N94 I95	V37-L90 HydrophobicContact CG1-CD2 4Å; V37-L90 HydrophobicContact CG1-CG 4.15Å; V37-L90 HydrophobicContact CG2-CD1 4.42Å; A40-L90 HydrophobicContact CB-CD2 3.98Å; Y66-L90 HydrophobicContact CE2-CD2 4.37Å; Y70-L90 HydrophobicContact CD2-CD1 4Å; Y70-L90 HydrophobicContact CE2-CD1 4.29Å; I73-L90 HydrophobicContact CD1-CD1 4.33Å; F79-L90 HydrophobicContact CE2-CD1 4.37Å; F86-L90 VanDerWaalsContact O-CB 3.3Å; F86-L90 WeakPolarHBondContact O-CB 3.21Å; F86-L90 VanDerWaalsContact O-CG 3.29Å; F86-L90 WeakPolarHBondContact O-CG 3.44Å; F86-L90 PolarHBondContact O-N 3.19Å; H87-L90 PolarHBondContact O-N 3.16Å; L90-N94 WeakPolarHBondContact O-CB 3.36Å; L90-N94 PolarHBondContact O-ND2 3.06Å; L90-I95 HydrophobicContact CB-CD1 3.99Å; L90-I95 HydrophobicContact CB-CG1 4.32Å; L90-I95 HydrophobicContact CD1-CD1 4.32Å
91	G	91.9	Very high	93.4	Very high	16 Å²	16	67.7 Å²	67.7	17%	0.165	36%	0.358	C	S	.	.			trans	78.4	113.3	-172.7	0	0	0	0	0	112.5	H87 G93 N94 I95	H87-G91 WeakPolarHBondContact O-CA 3.33Å; H87-G91 PolarHBondContact O-N 3.3Å; G91-G93 PolarHBondContact O-N 3.28Å; G91-N94 WeakPolarHBondContact O-CB 3.33Å; G91-N94 PolarHBondContact O-N 2.99Å; G91-I95 PolarHBondContact O-N 3.08Å; G91-I95 VanDerWaalsContact O-N 3.16Å
92	P	90.9	Very high	93.4	Very high	89 Å²	89	59.8 Å²	59.8	58%	0.578	32%	0.322	S	S	*	.	H	α-helix	trans	-58.6	-35.6	179.9	-26.1	36.2	0	0	0	113.3	H87 I95 K96	H87-P92 WeakPolarHBondContact O-CD 3.4Å; P92-I95 PolarHBondContact O-N 3.49Å; P92-K96 PolarHBondContact O-N 3.5Å
93	G	92.6	Very high	93.5	Very high	52 Å²	52	61.1 Å²	61.1	54%	0.536	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-36.2	173.9	0	0	0	0	0	113.6	G91 K96 K97	G91-G93 PolarHBondContact O-N 3.28Å; G93-K96 PolarHBondContact O-N 3.4Å; G93-K97 VanDerWaalsContact O-CB 3.26Å; G93-K97 WeakPolarHBondContact O-CB 3.47Å; G93-K97 PolarHBondContact O-N 2.79Å
94	N	93.9	Very high	93.7	Very high	60 Å²	60	63 Å²	63	32%	0.321	33%	0.332	S	S	.	.	H	α-helix	trans	-68	-39.9	175.7	-59.5	-28.4	0	0	0	110.9	F44 L90 G91 K97 A98	F44-N94 HydrophobicContact CD1-CB 4.28Å; F44-N94 HydrophobicContact CD2-CB 4.38Å; F44-N94 HydrophobicContact CE1-CB 3.8Å; F44-N94 HydrophobicContact CE2-CB 3.92Å; F44-N94 VanDerWaalsContact CE2-O 3.31Å; F44-N94 WeakPolarHBondContact CE2-O 3.09Å; F44-N94 HydrophobicContact CZ-CB 3.61Å; L90-N94 WeakPolarHBondContact O-CB 3.36Å; L90-N94 PolarHBondContact O-ND2 3.06Å; G91-N94 WeakPolarHBondContact O-CB 3.33Å; G91-N94 PolarHBondContact O-N 2.99Å; N94-K97 PolarHBondContact O-N 3.44Å; N94-A98 VanDerWaalsContact O-CB 3.29Å; N94-A98 WeakPolarHBondContact O-CB 3.16Å; N94-A98 PolarHBondContact O-N 3.41Å
95	I	94	Very high	93.8	Very high	21 Å²	21	57.1 Å²	57.1	11%	0.108	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-45.2	176.8	-60.2	165.5	0	0	0	110.6	Y66 Y70 L90 G91 P92 V99	Y66-I95 HydrophobicContact CE1-CG1 4.19Å; Y66-I95 WeakPolarHBondContact OH-CG1 2.94Å; Y70-I95 HydrophobicContact CD1-CG2 3.84Å; Y70-I95 HydrophobicContact CD2-CD1 4.29Å; Y70-I95 HydrophobicContact CE1-CG2 3.61Å; Y70-I95 HydrophobicContact CE2-CD1 3.82Å; Y70-I95 HydrophobicContact CG-CG2 4.43Å; L90-I95 HydrophobicContact CB-CD1 3.99Å; L90-I95 HydrophobicContact CB-CG1 4.32Å; L90-I95 HydrophobicContact CD1-CD1 4.32Å; G91-I95 PolarHBondContact O-N 3.08Å; G91-I95 VanDerWaalsContact O-N 3.16Å; P92-I95 PolarHBondContact O-N 3.49Å; I95-V99 PolarHBondContact O-N 3.14Å
96	K	95.4	Very high	93.7	Very high	129 Å²	129	52.1 Å²	52.1	56%	0.561	28%	0.282	S	S	*	.	H	α-helix	trans	-61.7	-51.4	175	-173.5	173.7	-178.6	-74.4	0	111.1	P92 G93 A98 V99 E100	P92-K96 PolarHBondContact O-N 3.5Å; G93-K96 PolarHBondContact O-N 3.4Å; K96-A98 VanDerWaalsContact C-N 3.31Å; K96-A98 PolarHBondContact O-N 3.38Å; K96-V99 PolarHBondContact O-N 2.72Å; K96-V99 VanDerWaalsContact O-N 3.08Å; K96-E100 WeakPolarHBondContact CE-OE1 3.36Å; K96-E100 IonicContact NZ-OE1 2.69Å; K96-E100 PolarHBondContact NZ-OE1 3.08Å; K96-E100 IonicContact NZ-OE2 4Å; K96-E100 PolarHBondContact NZ-OE2 2.72Å; K96-E100 WeakPolarHBondContact O-CG 3.43Å; K96-E100 PolarHBondContact O-N 2.84Å; K96-E100 VanDerWaalsContact O-N 3.08Å
97	K	95.9	Very high	93.7	Very high	63 Å²	63	55.9 Å²	55.9	27%	0.274	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-37.7	179.8	-168.3	-175.3	-177.5	-160	0	112.8	F44 E48 G93 N94 V99 E100 E101	F44-K97 HydrophobicContact CZ-CD 4.48Å; E48-K97 WeakPolarHBondContact OE1-CE 3.45Å; E48-K97 IonicContact OE1-NZ 2.66Å; E48-K97 PolarHBondContact OE1-NZ 2.78Å; E48-K97 IonicContact OE2-NZ 3.46Å; E48-K97 PolarHBondContact OE2-NZ 2.87Å; G93-K97 VanDerWaalsContact O-CB 3.26Å; G93-K97 WeakPolarHBondContact O-CB 3.47Å; G93-K97 PolarHBondContact O-N 2.79Å; N94-K97 PolarHBondContact O-N 3.44Å; K97-V99 VanDerWaalsContact C-N 3.26Å; K97-V99 PolarHBondContact O-N 3.34Å; K97-E100 PolarHBondContact O-N 3.03Å; K97-E101 HydrophobicContact CG-CG 3.9Å; K97-E101 WeakPolarHBondContact O-CB 3.35Å; K97-E101 WeakPolarHBondContact O-CG 3.48Å; K97-E101 PolarHBondContact O-N 2.92Å
98	A	95.6	Very high	93.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.4	-29.7	177.6	0	0	0	0	0	113.1	F44 Y63 Y66 V67 N94 K96 A102	F44-A98 HydrophobicContact CD2-CB 4.16Å; F44-A98 HydrophobicContact CE2-CB 4.02Å; Y63-A98 HydrophobicContact CD1-CB 4.01Å; Y66-A98 HydrophobicContact CD1-CB 3.49Å; Y66-A98 VanDerWaalsContact CD1-CB 3.49Å; Y66-A98 HydrophobicContact CE1-CB 3.83Å; Y66-A98 HydrophobicContact CG-CB 4.34Å; V67-A98 HydrophobicContact CG2-CB 4.01Å; N94-A98 VanDerWaalsContact O-CB 3.29Å; N94-A98 WeakPolarHBondContact O-CB 3.16Å; N94-A98 PolarHBondContact O-N 3.41Å; K96-A98 VanDerWaalsContact C-N 3.31Å; K96-A98 PolarHBondContact O-N 3.38Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 3.41Å
99	V	95.3	Very high	93.6	Very high	76 Å²	76	51 Å²	51	46%	0.461	27%	0.271	S	S	.	.	H	α-helix	trans	-75.8	-46.7	172.6	177.1	0	0	0	0	110.3	V67 I95 K96 K97 A102 E103	V67-V99 HydrophobicContact CG1-CG2 4.34Å; V67-V99 HydrophobicContact CG2-CG2 3.8Å; I95-V99 PolarHBondContact O-N 3.14Å; K96-V99 PolarHBondContact O-N 2.72Å; K96-V99 VanDerWaalsContact O-N 3.08Å; K97-V99 VanDerWaalsContact C-N 3.26Å; K97-V99 PolarHBondContact O-N 3.34Å; V99-A102 PolarHBondContact O-N 2.63Å; V99-E103 PolarHBondContact O-N 3.25Å
100	E	96	Very high	93.6	Very high	96 Å²	96	52.2 Å²	52.2	45%	0.449	27%	0.273	S	S	.	.	H	α-helix	trans	-64.1	-43	-178.2	-66.9	172.2	150.7	0	0	112.8	K96 K97 R104	K96-E100 WeakPolarHBondContact CE-OE1 3.36Å; K96-E100 IonicContact NZ-OE1 2.69Å; K96-E100 PolarHBondContact NZ-OE1 3.08Å; K96-E100 IonicContact NZ-OE2 4Å; K96-E100 PolarHBondContact NZ-OE2 2.72Å; K96-E100 WeakPolarHBondContact O-CG 3.43Å; K96-E100 PolarHBondContact O-N 2.84Å; K96-E100 VanDerWaalsContact O-N 3.08Å; K97-E100 PolarHBondContact O-N 3.03Å; E100-R104 VanDerWaalsContact O-CB 3.24Å; E100-R104 WeakPolarHBondContact O-CB 3.39Å; E100-R104 PolarHBondContact O-N 3.37Å
101	E	94.7	Very high	93.5	Very high	24 Å²	24	57.5 Å²	57.5	11%	0.112	30%	0.301	C	S	.	.	H	α-helix	trans	-70.7	-33.8	174.7	-69.4	-75.9	-173.7	0	0	112.1	R51 Y63 K97 R104 L105	R51-E101 WeakPolarHBondContact CD-OE1 3.33Å; R51-E101 WeakPolarHBondContact CD-OE2 3.35Å; R51-E101 IonicContact NE-OE1 3.88Å; Y63-E101 HydrophobicContact CD1-CB 4.41Å; Y63-E101 HydrophobicContact CD2-CB 3.89Å; Y63-E101 HydrophobicContact CE1-CB 4.3Å; Y63-E101 HydrophobicContact CE2-CB 3.78Å; Y63-E101 HydrophobicContact CE2-CG 4.35Å; Y63-E101 HydrophobicContact CG-CB 4.23Å; K97-E101 HydrophobicContact CG-CG 3.9Å; K97-E101 WeakPolarHBondContact O-CB 3.35Å; K97-E101 WeakPolarHBondContact O-CG 3.48Å; K97-E101 PolarHBondContact O-N 2.92Å; E101-R104 IonicContact OE2-CZ 3.47Å; E101-R104 VanDerWaalsContact OE2-CZ 3.23Å; E101-R104 IonicContact OE2-NE 3.37Å; E101-R104 PolarHBondContact OE2-NE 3.31Å; E101-R104 IonicContact OE2-NH2 2.75Å; E101-R104 PolarHBondContact OE2-NH2 3.29Å; E101-L105 WeakPolarHBondContact O-CB 3.43Å; E101-L105 WeakPolarHBondContact O-CD1 3.42Å; E101-L105 WeakPolarHBondContact O-CG 3.33Å; E101-L105 PolarHBondContact O-N 2.71Å
102	A	93.8	Very high	93.4	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.033	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-49.6	173.6	0	0	0	0	0	110.8	Y60 M64 A98 V99 L105 S106	Y60-A102 WeakPolarHBondContact CD2-O 3.4Å; Y60-A102 VanDerWaalsContact CE2-O 3.26Å; Y60-A102 WeakPolarHBondContact CE2-O 3.32Å; M64-A102 HydrophobicContact CE-CB 4.29Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 3.41Å; V99-A102 PolarHBondContact O-N 2.63Å; A102-L105 PolarHBondContact O-N 2.71Å; A102-S106 PolarHBondContact O-N 3.32Å; A102-S106 PolarHBondContact O-OG 2.91Å
103	E	94.3	Very high	93.3	Very high	120 Å²	120	55.6 Å²	55.6	56%	0.561	28%	0.277	S	S	*	.	H	α-helix	trans	-59.9	-49.5	179.2	-162.7	68.5	-165.9	0	0	111.5	V99 L105 S106 E107	V99-E103 PolarHBondContact O-N 3.25Å; E103-L105 VanDerWaalsContact C-N 3.28Å; E103-L105 PolarHBondContact O-N 3.23Å; E103-S106 WeakPolarHBondContact CA-OG 3.3Å; E103-S106 PolarHBondContact O-N 2.94Å; E103-S106 PolarHBondContact O-OG 3.3Å; E103-E107 PolarHBondContact O-N 2.84Å
104	R	95.4	Very high	93	Very high	120 Å²	120	58.9 Å²	58.9	45%	0.453	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-37.6	177.9	-168.9	-165.2	64.9	64.6	2.5	112.3	E100 E101 S108	E100-R104 VanDerWaalsContact O-CB 3.24Å; E100-R104 WeakPolarHBondContact O-CB 3.39Å; E100-R104 PolarHBondContact O-N 3.37Å; E101-R104 IonicContact OE2-CZ 3.47Å; E101-R104 VanDerWaalsContact OE2-CZ 3.23Å; E101-R104 IonicContact OE2-NE 3.37Å; E101-R104 PolarHBondContact OE2-NE 3.31Å; E101-R104 IonicContact OE2-NH2 2.75Å; E101-R104 PolarHBondContact OE2-NH2 3.29Å; R104-S108 PolarHBondContact O-N 3.2Å
105	L	93.7	Very high	92.7	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-78.9	-31.9	177.6	-72.2	168.4	0	0	0	112.6	E56 A59 Y60 Y63 E101 A102 E103 S108 L109	E56-L105 HydrophobicContact CB-CD2 3.84Å; E56-L105 HydrophobicContact CG-CD2 3.75Å; A59-L105 HydrophobicContact CB-CD1 3.75Å; Y60-L105 HydrophobicContact CD2-CB 3.9Å; Y60-L105 HydrophobicContact CG-CB 4.42Å; Y63-L105 HydrophobicContact CD2-CD1 3.85Å; Y63-L105 HydrophobicContact CE2-CD1 4.09Å; E101-L105 WeakPolarHBondContact O-CB 3.43Å; E101-L105 WeakPolarHBondContact O-CD1 3.42Å; E101-L105 WeakPolarHBondContact O-CG 3.33Å; E101-L105 PolarHBondContact O-N 2.71Å; A102-L105 PolarHBondContact O-N 2.71Å; E103-L105 VanDerWaalsContact C-N 3.28Å; E103-L105 PolarHBondContact O-N 3.23Å; L105-S108 PolarHBondContact O-N 3.35Å; L105-L109 VanDerWaalsContact O-CB 3.29Å; L105-L109 WeakPolarHBondContact O-CB 3.27Å; L105-L109 VanDerWaalsContact O-CG 3.22Å; L105-L109 WeakPolarHBondContact O-CG 3.32Å; L105-L109 PolarHBondContact O-N 2.96Å
106	S	92.5	Very high	92.3	Very high	9 Å²	9	63 Å²	63	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-45.3	175	24.5	0	0	0	0	112.3	A102 E103 L109 K110	A102-S106 PolarHBondContact O-N 3.32Å; A102-S106 PolarHBondContact O-OG 2.91Å; E103-S106 WeakPolarHBondContact CA-OG 3.3Å; E103-S106 PolarHBondContact O-N 2.94Å; E103-S106 PolarHBondContact O-OG 3.3Å; S106-L109 PolarHBondContact O-N 2.78Å; S106-K110 WeakPolarHBondContact O-CB 3.41Å; S106-K110 PolarHBondContact O-N 3.2Å
107	E	92.6	Very high	91.8	Very high	84 Å²	84	61 Å²	61	39%	0.393	30%	0.296	S	S	.	.	H	α-helix	trans	-70.7	-36.5	-180	-68.1	-61.6	116.8	0	0	111.9	E103 K110 L111	E103-E107 PolarHBondContact O-N 2.84Å; E107-K110 WeakPolarHBondContact OE1-CD 3.43Å; E107-K110 IonicContact OE1-NZ 3.15Å; E107-K110 PolarHBondContact OE1-NZ 3.47Å; E107-K110 IonicContact OE2-NZ 2.72Å; E107-K110 PolarHBondContact OE2-NZ 2.68Å; E107-L111 WeakPolarHBondContact O-CG 3.17Å; E107-L111 PolarHBondContact O-N 2.83Å
108	S	92.3	Very high	91.4	Very high	33 Å²	33	60.8 Å²	60.8	23%	0.231	30%	0.3	C	S	.	.	H	α-helix	trans	-58.1	-53.2	169.9	-171.1	0	0	0	0	111.5	E56 R104 L105 K110 L111 R112	E56-S108 WeakPolarHBondContact OE1-CB 3.29Å; E56-S108 PolarHBondContact OE1-OG 2.91Å; E56-S108 PolarHBondContact OE2-OG 3.44Å; R104-S108 PolarHBondContact O-N 3.2Å; L105-S108 PolarHBondContact O-N 3.35Å; S108-K110 PolarHBondContact O-N 3.21Å; S108-L111 PolarHBondContact O-N 2.96Å; S108-R112 WeakPolarHBondContact O-CG 3.4Å; S108-R112 PolarHBondContact O-N 2.79Å
109	L	91.5	Very high	90.9	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.7	-37.8	-177.8	-72.5	170.7	0	0	0	112.8	L11 L17 L20 E56 E57 Y60 L105 S106 R112 Y113	L11-L109 HydrophobicContact CD2-CD2 3.81Å; L17-L109 HydrophobicContact CD1-CB 4.34Å; L20-L109 HydrophobicContact CD2-CD1 3.72Å; E56-L109 HydrophobicContact CB-CD2 3.79Å; E56-L109 HydrophobicContact CB-CG 4.25Å; E57-L109 HydrophobicContact CG-CD2 3.67Å; Y60-L109 HydrophobicContact CD1-CD1 4.2Å; Y60-L109 HydrophobicContact CG-CD1 3.85Å; L105-L109 VanDerWaalsContact O-CB 3.29Å; L105-L109 WeakPolarHBondContact O-CB 3.27Å; L105-L109 VanDerWaalsContact O-CG 3.22Å; L105-L109 WeakPolarHBondContact O-CG 3.32Å; L105-L109 PolarHBondContact O-N 2.96Å; S106-L109 PolarHBondContact O-N 2.78Å; L109-R112 PolarHBondContact O-N 3.06Å; L109-Y113 HydrophobicContact CB-CD2 4.36Å; L109-Y113 HydrophobicContact CB-CE2 4.11Å; L109-Y113 WeakPolarHBondContact O-CB 3.44Å; L109-Y113 WeakPolarHBondContact O-CD2 3.46Å; L109-Y113 PolarHBondContact O-N 2.84Å
110	K	91.5	Very high	90.6	Very high	97 Å²	97	70.6 Å²	70.6	42%	0.422	33%	0.333	S	S	.	.	H	α-helix	trans	-57	-51	175.4	174.9	-175.5	171.1	-164.6	0	111.3	L17 S106 E107 S108 Y113 E114	L17-K110 HydrophobicContact CD2-CB 4.35Å; S106-K110 WeakPolarHBondContact O-CB 3.41Å; S106-K110 PolarHBondContact O-N 3.2Å; E107-K110 WeakPolarHBondContact OE1-CD 3.43Å; E107-K110 IonicContact OE1-NZ 3.15Å; E107-K110 PolarHBondContact OE1-NZ 3.47Å; E107-K110 IonicContact OE2-NZ 2.72Å; E107-K110 PolarHBondContact OE2-NZ 2.68Å; S108-K110 PolarHBondContact O-N 3.21Å; K110-Y113 PolarHBondContact O-N 3.37Å; K110-E114 PolarHBondContact O-N 3.39Å; K110-E114 VanDerWaalsContact O-N 3.13Å
111	L	90.3	Very high	90.1	Very high	112 Å²	112	71.2 Å²	71.2	59%	0.586	33%	0.334	S	S	*	.	H	α-helix	trans	-62.1	-41.9	175.2	-68.5	171.1	0	0	0	111.9	E107 S108 E114 E115	E107-L111 WeakPolarHBondContact O-CG 3.17Å; E107-L111 PolarHBondContact O-N 2.83Å; S108-L111 PolarHBondContact O-N 2.96Å; L111-E114 PolarHBondContact O-N 2.9Å; L111-E115 WeakPolarHBondContact O-CB 3.38Å; L111-E115 PolarHBondContact O-N 3.12Å
112	R	89.3	Confident	89.6	Confident	41 Å²	41	74.7 Å²	74.7	16%	0.155	35%	0.352	C	S	.	.	H	α-helix	trans	-69.4	-34.7	179.8	-68.6	-176.1	67.5	-147.8	-8	113.8	K9 L11 E56 S108 L109 E114 A116	K9-R112 PolarHBondContact O-NH1 3Å; K9-R112 PolarHBondContact O-NH2 3.25Å; L11-R112 HydrophobicContact CD1-CB 4.09Å; E56-R112 VanDerWaalsContact OE2-CD 3.28Å; E56-R112 WeakPolarHBondContact OE2-CD 3.37Å; E56-R112 IonicContact OE2-CZ 2.79Å; E56-R112 IonicContact OE2-NE 2.68Å; E56-R112 IonicContact OE2-NH1 3.44Å; E56-R112 PolarHBondContact OE2-NH1 2.69Å; S108-R112 WeakPolarHBondContact O-CG 3.4Å; S108-R112 PolarHBondContact O-N 2.79Å; L109-R112 PolarHBondContact O-N 3.06Å; R112-E114 VanDerWaalsContact C-N 3.35Å; R112-A116 WeakPolarHBondContact O-CB 3.35Å; R112-A116 PolarHBondContact O-N 3.2Å
113	Y	87.9	Confident	89.2	Confident	23 Å²	23	79.3 Å²	79.3	9%	0.09	37%	0.373	C	S	.	.	H	α-helix	trans	-66.4	-39	171.9	-75.1	-55.3	0	0	0	111.2	L11 S14 L17 E57 L109 K110 E117	L11-Y113 HydrophobicContact CB-CE1 4.43Å; L11-Y113 HydrophobicContact CD1-CD1 3.67Å; L11-Y113 HydrophobicContact CD1-CE1 3.92Å; L11-Y113 HydrophobicContact CD1-CG 4.33Å; L11-Y113 HydrophobicContact CD2-CE1 4.13Å; L11-Y113 HydrophobicContact CG-CE1 4.39Å; S14-Y113 WeakPolarHBondContact O-CE1 3.44Å; L17-Y113 HydrophobicContact CB-CD2 4.3Å; L17-Y113 HydrophobicContact CB-CE2 4.28Å; E57-Y113 PolarHBondContact OE1-OH 3.48Å; L109-Y113 HydrophobicContact CB-CD2 4.36Å; L109-Y113 HydrophobicContact CB-CE2 4.11Å; L109-Y113 WeakPolarHBondContact O-CB 3.44Å; L109-Y113 WeakPolarHBondContact O-CD2 3.46Å; L109-Y113 PolarHBondContact O-N 2.84Å; K110-Y113 PolarHBondContact O-N 3.37Å; Y113-E117 VanDerWaalsContact O-CB 3.3Å; Y113-E117 WeakPolarHBondContact O-CB 3.36Å; Y113-E117 PolarHBondContact O-N 2.94Å; Y113-E117 VanDerWaalsContact O-N 3.13Å
114	E	88.1	Confident	89	Confident	122 Å²	122	76.9 Å²	76.9	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-66.6	-46.4	175.1	-176.8	161.5	-145.1	0	0	111.7	K110 L111 R112 A116 E117 V118	K110-E114 PolarHBondContact O-N 3.39Å; K110-E114 VanDerWaalsContact O-N 3.13Å; L111-E114 PolarHBondContact O-N 2.9Å; R112-E114 VanDerWaalsContact C-N 3.35Å; E114-A116 PolarHBondContact O-N 3.14Å; E114-E117 PolarHBondContact O-N 3.37Å; E114-V118 HydrophobicContact CG-CG2 4.48Å; E114-V118 WeakPolarHBondContact O-CB 3.48Å; E114-V118 VanDerWaalsContact O-CG2 3.31Å; E114-V118 WeakPolarHBondContact O-CG2 3.42Å; E114-V118 PolarHBondContact O-N 2.88Å
115	E	86.6	Confident	88.6	Confident	121 Å²	121	75.1 Å²	75.1	57%	0.565	36%	0.358	S	S	*	.	H	α-helix	trans	-54.8	-50.2	174.1	-171.4	-160.1	157.1	0	0	111.6	L111 E117 V118 R119	L111-E115 WeakPolarHBondContact O-CB 3.38Å; L111-E115 PolarHBondContact O-N 3.12Å; E115-E117 PolarHBondContact O-N 2.93Å; E115-V118 PolarHBondContact O-N 3.2Å; E115-R119 WeakPolarHBondContact O-CB 3.35Å; E115-R119 PolarHBondContact O-N 3.45Å
116	A	85.2	Confident	88.4	Confident	47 Å²	47	78.6 Å²	78.6	39%	0.388	38%	0.376	S	S	.	.	H	α-helix	trans	-62.7	-40.1	-179.4	0	0	0	0	0	112.6	L11 R112 E114 K120	L11-A116 HydrophobicContact CD1-CB 4.31Å; R112-A116 WeakPolarHBondContact O-CB 3.35Å; R112-A116 PolarHBondContact O-N 3.2Å; E114-A116 PolarHBondContact O-N 3.14Å; A116-K120 VanDerWaalsContact O-CB 3.26Å; A116-K120 WeakPolarHBondContact O-CB 3.32Å; A116-K120 PolarHBondContact O-N 3.42Å
117	E	85.2	Confident	88.4	Confident	86 Å²	86	85.4 Å²	85.4	40%	0.402	40%	0.401	S	S	.	.	H	α-helix	trans	-74.1	-31	178.9	174.8	63.8	-171.5	0	0	112.6	Y113 E114 E115 K121	Y113-E117 VanDerWaalsContact O-CB 3.3Å; Y113-E117 WeakPolarHBondContact O-CB 3.36Å; Y113-E117 PolarHBondContact O-N 2.94Å; Y113-E117 VanDerWaalsContact O-N 3.13Å; E114-E117 PolarHBondContact O-N 3.37Å; E115-E117 PolarHBondContact O-N 2.93Å; E117-K121 VanDerWaalsContact CG-NZ 3.31Å; E117-K121 WeakPolarHBondContact O-CD 3.39Å; E117-K121 WeakPolarHBondContact O-CG 3.49Å; E117-K121 PolarHBondContact O-N 3.47Å; E117-K121 WeakPolarHBondContact OE1-CE 3.37Å; E117-K121 IonicContact OE1-NZ 3.6Å; E117-K121 PolarHBondContact OE1-NZ 3.34Å
118	V	88.7	Confident	88.2	Confident	58 Å²	58	86.1 Å²	86.1	35%	0.352	40%	0.404	S	S	.	.	H	α-helix	trans	-72.2	-46.7	170.6	169.6	0	0	0	0	110.9	E114 E115 K120 K121 L122 T177	E114-V118 HydrophobicContact CG-CG2 4.48Å; E114-V118 WeakPolarHBondContact O-CB 3.48Å; E114-V118 VanDerWaalsContact O-CG2 3.31Å; E114-V118 WeakPolarHBondContact O-CG2 3.42Å; E114-V118 PolarHBondContact O-N 2.88Å; E115-V118 PolarHBondContact O-N 3.2Å; V118-K120 PolarHBondContact O-N 3.07Å; V118-K121 WeakPolarHBondContact O-CB 3.47Å; V118-K121 PolarHBondContact O-N 3Å; V118-K121 VanDerWaalsContact O-N 3.1Å; V118-L122 PolarHBondContact O-N 2.94Å; V118-T177 HydrophobicContact CG1-CG2 4.44Å; V118-T177 HydrophobicContact CG2-CG2 4.18Å
119	R	84.9	Confident	88.1	Confident	147 Å²	147	88.4 Å²	88.4	56%	0.555	41%	0.411	S	S	*	.	H	α-helix	trans	-57.5	-48	178.3	177	176.3	173.4	149.7	7.2	111.7	E115 K121 L122 E123	E115-R119 WeakPolarHBondContact O-CB 3.35Å; E115-R119 PolarHBondContact O-N 3.45Å; R119-K121 VanDerWaalsContact C-N 3.26Å; R119-K121 PolarHBondContact O-N 3.05Å; R119-L122 WeakPolarHBondContact O-CB 3.49Å; R119-L122 PolarHBondContact O-N 3.34Å; R119-E123 HydrophobicContact CG-CG 4.41Å; R119-E123 IonicContact CZ-OE1 2.74Å; R119-E123 IonicContact NE-OE1 2.69Å; R119-E123 PolarHBondContact NE-OE1 3.29Å; R119-E123 IonicContact NH2-OE1 3.24Å; R119-E123 PolarHBondContact NH2-OE1 2.99Å; R119-E123 WeakPolarHBondContact O-CG 2.8Å; R119-E123 PolarHBondContact O-N 2.85Å
120	K	88.5	Confident	88.1	Confident	136 Å²	136	95.1 Å²	95.1	59%	0.591	44%	0.442	S	S	*	.	H	α-helix	trans	-57.8	-36.7	175.8	178.9	-176.1	170.3	-165	0	112.7	A116 V118 E124	A116-K120 VanDerWaalsContact O-CB 3.26Å; A116-K120 WeakPolarHBondContact O-CB 3.32Å; A116-K120 PolarHBondContact O-N 3.42Å; V118-K120 PolarHBondContact O-N 3.07Å; K120-E124 VanDerWaalsContact O-CB 3.28Å; K120-E124 WeakPolarHBondContact O-CB 3.47Å; K120-E124 PolarHBondContact O-N 3.12Å
121	K	84.8	Confident	88	Confident	109 Å²	109	93.1 Å²	93.1	47%	0.474	44%	0.444	S	S	.	.	H	α-helix	trans	-70.8	-35.6	175	-73.8	165.5	-174.7	148.9	0	112.5	E117 V118 R119 K125	E117-K121 VanDerWaalsContact CG-NZ 3.31Å; E117-K121 WeakPolarHBondContact O-CD 3.39Å; E117-K121 WeakPolarHBondContact O-CG 3.49Å; E117-K121 PolarHBondContact O-N 3.47Å; E117-K121 WeakPolarHBondContact OE1-CE 3.37Å; E117-K121 IonicContact OE1-NZ 3.6Å; E117-K121 PolarHBondContact OE1-NZ 3.34Å; V118-K121 WeakPolarHBondContact O-CB 3.47Å; V118-K121 PolarHBondContact O-N 3Å; V118-K121 VanDerWaalsContact O-N 3.1Å; R119-K121 VanDerWaalsContact C-N 3.26Å; R119-K121 PolarHBondContact O-N 3.05Å; K121-K125 WeakPolarHBondContact O-CB 3.38Å; K121-K125 PolarHBondContact O-N 3.28Å
122	L	83.8	Confident	88	Confident	96 Å²	96	93.1 Å²	93.1	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-67.8	-48.6	175.7	-169.6	68.3	0	0	0	111	V118 R119 E124 K125 D126	V118-L122 PolarHBondContact O-N 2.94Å; R119-L122 WeakPolarHBondContact O-CB 3.49Å; R119-L122 PolarHBondContact O-N 3.34Å; L122-E124 VanDerWaalsContact C-N 3.29Å; L122-E124 PolarHBondContact O-N 3.29Å; L122-K125 WeakPolarHBondContact O-CB 3.49Å; L122-K125 PolarHBondContact O-N 2.83Å; L122-K125 VanDerWaalsContact O-N 3.13Å; L122-D126 VanDerWaalsContact O-CG 3.3Å; L122-D126 PolarHBondContact O-N 3.47Å
123	E	86.8	Confident	88.1	Confident	101 Å²	101	99.7 Å²	99.7	47%	0.472	47%	0.466	S	S	.	.	H	α-helix	trans	-60.1	-37.1	175.9	-69.2	172.2	171.1	0	0	111.8	R119 R127	R119-E123 HydrophobicContact CG-CG 4.41Å; R119-E123 IonicContact CZ-OE1 2.74Å; R119-E123 IonicContact NE-OE1 2.69Å; R119-E123 PolarHBondContact NE-OE1 3.29Å; R119-E123 IonicContact NH2-OE1 3.24Å; R119-E123 PolarHBondContact NH2-OE1 2.99Å; R119-E123 WeakPolarHBondContact O-CG 2.8Å; R119-E123 PolarHBondContact O-N 2.85Å; E123-R127 WeakPolarHBondContact O-CB 3.38Å; E123-R127 PolarHBondContact O-N 2.8Å
124	E	89.1	Confident	88.2	Confident	70 Å²	70	103.7 Å²	103.7	33%	0.327	49%	0.488	S	S	.	.	H	α-helix	trans	-67.8	-44.7	172	-178	64.4	-122.9	0	0	112.6	K120 L122 R127 Q128	K120-E124 VanDerWaalsContact O-CB 3.28Å; K120-E124 WeakPolarHBondContact O-CB 3.47Å; K120-E124 PolarHBondContact O-N 3.12Å; L122-E124 VanDerWaalsContact C-N 3.29Å; L122-E124 PolarHBondContact O-N 3.29Å; E124-R127 PolarHBondContact O-N 2.93Å; E124-R127 IonicContact OE1-CZ 2.85Å; E124-R127 IonicContact OE1-NE 2.86Å; E124-R127 IonicContact OE1-NH2 2.68Å; E124-R127 PolarHBondContact OE1-NH2 3.32Å; E124-R127 IonicContact OE2-CZ 3.65Å; E124-R127 IonicContact OE2-NH1 2.88Å; E124-R127 IonicContact OE2-NH2 3.61Å; E124-R127 PolarHBondContact OE2-NH2 2.79Å; E124-Q128 WeakPolarHBondContact O-CG 3.39Å; E124-Q128 PolarHBondContact O-N 2.99Å; E124-Q128 PolarHBondContact OE1-NE2 3.1Å
125	K	88.3	Confident	88.2	Confident	83 Å²	83	103.8 Å²	103.8	36%	0.361	49%	0.489	S	S	.	.	H	α-helix	trans	-59.2	-49.2	177.2	-174.6	-164	68.4	60.1	0	111.1	K121 L122 R127 Q128 E129	K121-K125 WeakPolarHBondContact O-CB 3.38Å; K121-K125 PolarHBondContact O-N 3.28Å; L122-K125 WeakPolarHBondContact O-CB 3.49Å; L122-K125 PolarHBondContact O-N 2.83Å; L122-K125 VanDerWaalsContact O-N 3.13Å; K125-R127 VanDerWaalsContact C-N 3.32Å; K125-R127 PolarHBondContact O-N 3Å; K125-Q128 PolarHBondContact O-N 3.44Å; K125-Q128 VanDerWaalsContact O-N 3.08Å; K125-E129 VanDerWaalsContact CD-OE1 3.32Å; K125-E129 WeakPolarHBondContact CD-OE1 3.35Å; K125-E129 WeakPolarHBondContact CG-OE1 3.43Å; K125-E129 IonicContact NZ-OE1 2.72Å; K125-E129 PolarHBondContact NZ-OE1 2.85Å; K125-E129 IonicContact NZ-OE2 3.66Å; K125-E129 PolarHBondContact NZ-OE2 3.16Å; K125-E129 PolarHBondContact O-N 3.15Å
126	D	89.6	Confident	88.1	Confident	75 Å²	75	103.1 Å²	103.1	40%	0.401	49%	0.486	S	S	.	.	H	α-helix	trans	-64.6	-39.7	-176.3	-67.3	-10.6	0	0	0	110.8	L122 Q128 E129 E130	L122-D126 VanDerWaalsContact O-CG 3.3Å; L122-D126 PolarHBondContact O-N 3.47Å; D126-Q128 VanDerWaalsContact C-N 3.33Å; D126-Q128 PolarHBondContact O-N 2.81Å; D126-E129 PolarHBondContact O-N 3.07Å; D126-E130 WeakPolarHBondContact O-CB 3.26Å; D126-E130 PolarHBondContact O-N 3.3Å
127	R	92	Very high	88.3	Confident	153 Å²	153	107.2 Å²	107.2	58%	0.577	50%	0.495	S	S	*	.	H	α-helix	trans	-60.8	-38.3	171.7	-170.8	-178.6	72.9	-177.2	4.2	112.8	E123 E124 K125 A131	E123-R127 WeakPolarHBondContact O-CB 3.38Å; E123-R127 PolarHBondContact O-N 2.8Å; E124-R127 PolarHBondContact O-N 2.93Å; E124-R127 IonicContact OE1-CZ 2.85Å; E124-R127 IonicContact OE1-NE 2.86Å; E124-R127 IonicContact OE1-NH2 2.68Å; E124-R127 PolarHBondContact OE1-NH2 3.32Å; E124-R127 IonicContact OE2-CZ 3.65Å; E124-R127 IonicContact OE2-NH1 2.88Å; E124-R127 IonicContact OE2-NH2 3.61Å; E124-R127 PolarHBondContact OE2-NH2 2.79Å; K125-R127 VanDerWaalsContact C-N 3.32Å; K125-R127 PolarHBondContact O-N 3Å; R127-A131 WeakPolarHBondContact O-CB 3.33Å; R127-A131 PolarHBondContact O-N 2.92Å
128	Q	88.1	Confident	88.2	Confident	98 Å²	98	112.5 Å²	112.5	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-72.8	-37.5	176.8	-70.7	177.7	22.8	0	0	112.4	E124 K125 D126 A131 Q132	E124-Q128 WeakPolarHBondContact O-CG 3.39Å; E124-Q128 PolarHBondContact O-N 2.99Å; E124-Q128 PolarHBondContact OE1-NE2 3.1Å; K125-Q128 PolarHBondContact O-N 3.44Å; K125-Q128 VanDerWaalsContact O-N 3.08Å; D126-Q128 VanDerWaalsContact C-N 3.33Å; D126-Q128 PolarHBondContact O-N 2.81Å; Q128-A131 PolarHBondContact O-N 2.82Å; Q128-Q132 WeakPolarHBondContact O-CB 3.49Å; Q128-Q132 VanDerWaalsContact O-CG 3.32Å; Q128-Q132 WeakPolarHBondContact O-CG 3.22Å; Q128-Q132 PolarHBondContact O-N 3.09Å
129	E	90.1	Very high	87.6	Confident	82 Å²	82	115.5 Å²	115.5	38%	0.383	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-39.8	174.8	-75.7	175.4	-160	0	0	112	K125 D126 Q132 R133	K125-E129 VanDerWaalsContact CD-OE1 3.32Å; K125-E129 WeakPolarHBondContact CD-OE1 3.35Å; K125-E129 WeakPolarHBondContact CG-OE1 3.43Å; K125-E129 IonicContact NZ-OE1 2.72Å; K125-E129 PolarHBondContact NZ-OE1 2.85Å; K125-E129 IonicContact NZ-OE2 3.66Å; K125-E129 PolarHBondContact NZ-OE2 3.16Å; K125-E129 PolarHBondContact O-N 3.15Å; D126-E129 PolarHBondContact O-N 3.07Å; E129-Q132 PolarHBondContact O-N 2.94Å; E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 VanDerWaalsContact O-CG 3.27Å; E129-R133 WeakPolarHBondContact O-CG 3.43Å; E129-R133 PolarHBondContact O-N 3.33Å
130	E	90.9	Very high	86.9	Confident	140 Å²	140	114.6 Å²	114.6	65%	0.654	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-44.5	173	-174.5	172.1	-147.3	0	0	111.5	D126 Q132 R133 L134	D126-E130 WeakPolarHBondContact O-CB 3.26Å; D126-E130 PolarHBondContact O-N 3.3Å; E130-Q132 PolarHBondContact O-N 3.12Å; E130-R133 PolarHBondContact O-N 2.83Å; E130-L134 WeakPolarHBondContact O-CB 3.47Å; E130-L134 PolarHBondContact O-N 3.11Å
131	A	90.6	Very high	85.6	Confident	56 Å²	56	113 Å²	113	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-60.7	-42.2	175.1	0	0	0	0	0	112.4	R127 Q128 L134 Q135	R127-A131 WeakPolarHBondContact O-CB 3.33Å; R127-A131 PolarHBondContact O-N 2.92Å; Q128-A131 PolarHBondContact O-N 2.82Å; A131-L134 PolarHBondContact O-N 2.77Å; A131-Q135 WeakPolarHBondContact O-CB 3.32Å; A131-Q135 PolarHBondContact O-N 3.47Å
132	Q	90.1	Very high	84.3	Confident	112 Å²	112	110.6 Å²	110.6	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-65.3	-45	175.5	-75.7	177.8	44.8	0	0	112.1	Q128 E129 E130 L134 Q135 Q136	Q128-Q132 WeakPolarHBondContact O-CB 3.49Å; Q128-Q132 VanDerWaalsContact O-CG 3.32Å; Q128-Q132 WeakPolarHBondContact O-CG 3.22Å; Q128-Q132 PolarHBondContact O-N 3.09Å; E129-Q132 PolarHBondContact O-N 2.94Å; E130-Q132 PolarHBondContact O-N 3.12Å; Q132-L134 VanDerWaalsContact C-N 3.34Å; Q132-L134 PolarHBondContact O-N 2.64Å; Q132-Q135 PolarHBondContact O-N 2.88Å; Q132-Q136 WeakPolarHBondContact O-CB 3.14Å; Q132-Q136 WeakPolarHBondContact O-CG 3.37Å; Q132-Q136 PolarHBondContact O-N 3.44Å
133	R	91.3	Very high	82.9	Confident	178 Å²	178	116.4 Å²	116.4	67%	0.672	55%	0.546	S	S	*	.	H	α-helix	trans	-59.4	-43.1	175	-75.7	169.2	176.6	-98.4	3.6	111.8	E129 E130 Q135 Q136 K137	E129-R133 WeakPolarHBondContact O-CB 3.48Å; E129-R133 VanDerWaalsContact O-CG 3.27Å; E129-R133 WeakPolarHBondContact O-CG 3.43Å; E129-R133 PolarHBondContact O-N 3.33Å; E130-R133 PolarHBondContact O-N 2.83Å; R133-Q135 VanDerWaalsContact C-N 3.35Å; R133-Q136 PolarHBondContact O-N 3.08Å; R133-K137 WeakPolarHBondContact O-CB 3.31Å; R133-K137 PolarHBondContact O-N 3.33Å
134	L	90.4	Very high	80.8	Confident	108 Å²	108	120.5 Å²	120.5	57%	0.565	57%	0.566	S	S	*	*	H	α-helix	trans	-65.1	-39	176.6	-176.3	61.8	0	0	0	111.6	E130 A131 Q132 R138	E130-L134 WeakPolarHBondContact O-CB 3.47Å; E130-L134 PolarHBondContact O-N 3.11Å; A131-L134 PolarHBondContact O-N 2.77Å; Q132-L134 VanDerWaalsContact C-N 3.34Å; Q132-L134 PolarHBondContact O-N 2.64Å; L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 2.83Å
135	Q	87.1	Confident	78.8	Confident	123 Å²	123	124.5 Å²	124.5	58%	0.575	59%	0.589	S	S	*	*	H	α-helix	trans	-70.7	-39	177.5	-168.4	171	10.7	0	0	112.5	A131 Q132 R133 R138 Q139	A131-Q135 WeakPolarHBondContact O-CB 3.32Å; A131-Q135 PolarHBondContact O-N 3.47Å; Q132-Q135 PolarHBondContact O-N 2.88Å; R133-Q135 VanDerWaalsContact C-N 3.35Å; Q135-R138 PolarHBondContact O-N 2.75Å; Q135-Q139 WeakPolarHBondContact O-CG 3.32Å; Q135-Q139 PolarHBondContact O-N 2.87Å; Q135-Q139 VanDerWaalsContact O-N 3.14Å
136	Q	85.6	Confident	76.5	Confident	107 Å²	107	124.4 Å²	124.4	50%	0.5	61%	0.612	S	S	.	*	H	α-helix	trans	-60.6	-52.1	171.6	-75.2	171	-12.5	0	0	110.8	Q132 R133 R138 Q139 E140	Q132-Q136 WeakPolarHBondContact O-CB 3.14Å; Q132-Q136 WeakPolarHBondContact O-CG 3.37Å; Q132-Q136 PolarHBondContact O-N 3.44Å; R133-Q136 PolarHBondContact O-N 3.08Å; Q136-R138 VanDerWaalsContact C-N 3.25Å; Q136-R138 PolarHBondContact O-N 3.04Å; Q136-Q139 WeakPolarHBondContact O-CA 3.38Å; Q136-Q139 WeakPolarHBondContact O-CB 3.01Å; Q136-Q139 PolarHBondContact O-N 3.44Å; Q136-E140 WeakPolarHBondContact O-CG 3.36Å; Q136-E140 PolarHBondContact O-N 3.42Å
137	K	88.3	Confident	74.1	Confident	134 Å²	134	123.5 Å²	123.5	58%	0.583	62%	0.62	S	S	*	*	H	α-helix	trans	-55.5	-39.8	177.7	-171.9	174.2	-177.2	177.8	0	112.3	R133 Q139 E140 T141	R133-K137 WeakPolarHBondContact O-CB 3.31Å; R133-K137 PolarHBondContact O-N 3.33Å; K137-Q139 VanDerWaalsContact C-N 3.34Å; K137-Q139 PolarHBondContact O-N 2.95Å; K137-E140 PolarHBondContact O-N 3.49Å; K137-T141 WeakPolarHBondContact O-CB 3Å; K137-T141 PolarHBondContact O-N 2.66Å; K137-T141 PolarHBondContact O-OG1 2.7Å
138	R	84.5	Confident	71.4	Confident	196 Å²	196	122.5 Å²	122.5	74%	0.74	63%	0.631	S	S	*	*	H	α-helix	trans	-67.9	-27.5	174.8	-73.8	-175.6	72.1	-157.2	1.3	114	L134 Q135 Q136 G142	L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 2.83Å; Q135-R138 PolarHBondContact O-N 2.75Å; Q136-R138 VanDerWaalsContact C-N 3.25Å; Q136-R138 PolarHBondContact O-N 3.04Å; R138-G142 PolarHBondContact O-N 3.42Å
139	Q	76.1	Confident	68.9	Low	122 Å²	122	125.6 Å²	125.6	57%	0.57	65%	0.65	S	S	*	*	H	α-helix	trans	-79.2	-32.9	173.7	-69.4	173.8	26.1	0	0	112.1	Q135 Q136 K137 G142	Q135-Q139 WeakPolarHBondContact O-CG 3.32Å; Q135-Q139 PolarHBondContact O-N 2.87Å; Q135-Q139 VanDerWaalsContact O-N 3.14Å; Q136-Q139 WeakPolarHBondContact O-CA 3.38Å; Q136-Q139 WeakPolarHBondContact O-CB 3.01Å; Q136-Q139 PolarHBondContact O-N 3.44Å; K137-Q139 VanDerWaalsContact C-N 3.34Å; K137-Q139 PolarHBondContact O-N 2.95Å; Q139-G142 PolarHBondContact O-N 3.45Å
140	E	69.9	Low	66.3	Low	128 Å²	128	125.7 Å²	125.7	60%	0.598	67%	0.665	S	S	*	*	H	α-helix	trans	-70.7	-51.7	175.6	-68.4	167.2	162.2	0	0	111.2	Q136 K137 G142 R143	Q136-E140 WeakPolarHBondContact O-CG 3.36Å; Q136-E140 PolarHBondContact O-N 3.42Å; K137-E140 PolarHBondContact O-N 3.49Å; E140-G142 PolarHBondContact O-N 3.05Å; E140-G142 VanDerWaalsContact O-N 3.12Å; E140-R143 PolarHBondContact O-N 2.87Å
141	T	59.8	Low	63.6	Low	101 Å²	101	129.2 Å²	129.2	62%	0.62	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-61.1	-22.2	174.2	-50.1	0	0	0	0	112.5	K137 R143	K137-T141 WeakPolarHBondContact O-CB 3Å; K137-T141 PolarHBondContact O-N 2.66Å; K137-T141 PolarHBondContact O-OG1 2.7Å; T141-R143 VanDerWaalsContact C-N 3.28Å; T141-R143 PolarHBondContact O-N 3.31Å
142	G	57.3	Low	60.8	Low	59 Å²	59	130.6 Å²	130.6	61%	0.608	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-80.6	8	174.8	0	0	0	0	0	115.7	R138 Q139 E140	R138-G142 PolarHBondContact O-N 3.42Å; Q139-G142 PolarHBondContact O-N 3.45Å; E140-G142 PolarHBondContact O-N 3.05Å; E140-G142 VanDerWaalsContact O-N 3.12Å
143	R	54.4	Low	58	Low	218 Å²	218	130.9 Å²	130.9	82%	0.823	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-115.4	-12.2	-179.3	-77.1	-176.7	173.8	-164.7	-0.7	115.8	E140 T141	E140-R143 PolarHBondContact O-N 2.87Å; T141-R143 VanDerWaalsContact C-N 3.28Å; T141-R143 PolarHBondContact O-N 3.31Å
144	E	44.4	Very low	55.4	Low	188 Å²	188	129 Å²	129	88%	0.879	71%	0.714	S	S	*	*	S	Bend	trans	-95.3	-8.5	-174.8	-63.8	-163.4	142.2	0	0	114.7
145	D	46.8	Very low	52.5	Low	153 Å²	153	132.7 Å²	132.7	82%	0.818	73%	0.729	S	S	*	*			trans	-122.5	106	171.4	-161	-6.5	0	0	0	110.3
146	G	39	Very low	49.8	Very low	82 Å²	82	132.7 Å²	132.7	85%	0.845	73%	0.733	S	S	*	*			trans	-157.4	18.6	-162.7	0	0	0	0	0	115.2
147	G	39.5	Very low	47.2	Very low	55 Å²	55	133.8 Å²	133.8	57%	0.567	75%	0.746	S	S	*	*			trans	-160.4	116.7	173.2	0	0	0	0	0	110.5
148	T	34.3	Very low	44.8	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	75%	0.754	S	S	*	*				-165.2	156.9	59.6	31.4	0	0	0	0	113.8
149	L	37.3	Very low	42.3	Very low	162 Å²	162	130.8 Å²	130.8	85%	0.848	75%	0.751	S	S	*	*			trans	48	110.1	147.6	-77.9	156.7	0	0	0	121.5
150	A	34.5	Very low	40.7	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	75%	0.746	S	S	*	*				97.1	153.6	117.1	0	0	0	0	0	121.3
151	K	34.7	Very low	39.1	Very low	214 Å²	214	130.1 Å²	130.1	93%	0.93	75%	0.753	S	S	*	*			trans	58.1	109.7	174	-71.8	-178.8	174.9	177.8	0	116.5
152	G	32.1	Very low	37.9	Very low	84 Å²	84	130.6 Å²	130.6	87%	0.866	75%	0.751	S	S	*	*			trans	-95.5	-175.8	164.1	0	0	0	0	0	112.7
153	S	31	Very low	37.1	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	75%	0.752	S	S	*	*			trans	-135.1	153.7	159.1	-172.3	0	0	0	0	109.3
154	L	35.9	Very low	36.1	Very low	138 Å²	138	129.2 Å²	129.2	72%	0.723	74%	0.744	S	S	*	*			trans	-64.1	142.9	155.7	-103.1	117.8	0	0	0	109	N156	L154-N156 WeakPolarHBondContact CD2-ND2 3.47Å
155	E	29.8	Very low	35.8	Very low	187 Å²	187	128 Å²	128	87%	0.874	74%	0.738	S	S	*	*				-148.3	142.8	110.2	-140.2	169.3	179.3	0	0	110.3
156	N	30.6	Very low	35.1	Very low	123 Å²	123	129.3 Å²	129.3	66%	0.658	74%	0.736	S	S	*	*			trans	-95.1	159.7	165.5	-71.3	-79.1	0	0	0	107.8	L154	L154-N156 WeakPolarHBondContact CD2-ND2 3.47Å
157	V	32	Very low	34.7	Very low	129 Å²	129	130.3 Å²	130.3	78%	0.782	73%	0.73	S	S	*	*				171.2	123.2	124	151	0	0	0	0	110.4
158	L	37.3	Very low	34.2	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	75%	0.748	S	S	*	*			trans	28.7	142.3	137	-43.3	177.7	0	0	0	120
159	D	31.6	Very low	34.3	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	75%	0.746	S	S	*	*			cis	-158.4	168.8	5.9	-137.2	-27.3	0	0	0	114.9
160	S	43.4	Very low	34.1	Very low	67 Å²	67	135.2 Å²	135.2	47%	0.469	75%	0.75	S	S	.	*			trans	8.7	150	133.9	-63.3	0	0	0	0	119.9
161	K	35.8	Very low	34.2	Very low	169 Å²	169	140.5 Å²	140.5	74%	0.735	76%	0.758	S	S	*	*			cis	-174	-179.3	4.3	-105.2	170.9	-163.1	105.9	0	105.2
162	D	34.9	Very low	34.6	Very low	111 Å²	111	138.1 Å²	138.1	59%	0.594	76%	0.755	S	S	*	*			cis	-165.4	165.7	0.1	-121.6	-8.7	0	0	0	105.7
163	K	39.4	Very low	34.9	Very low	141 Å²	141	142.3 Å²	142.3	61%	0.613	75%	0.752	S	S	*	*			cis	-168.9	144.7	-12.8	-153.8	-171.1	-133.3	70.6	0	109.2
164	T	33.5	Very low	35.9	Very low	107 Å²	107	145.6 Å²	145.6	66%	0.656	75%	0.751	S	S	*	*			trans	60.3	164.6	154	33.4	0	0	0	0	118.8
165	Q	37.6	Very low	35.9	Very low	163 Å²	163	143.6 Å²	143.6	76%	0.762	75%	0.748	S	S	*	*			cis	-139.7	131.4	6.6	-128	152.5	7.9	0	0	108.4
166	K	32.7	Very low	36.4	Very low	180 Å²	180	140.3 Å²	140.3	78%	0.783	73%	0.733	S	S	*	*				41.2	107.9	108.3	-64.2	-169.3	176.4	-171.6	0	114.3
167	S	32	Very low	36.7	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	73%	0.734	S	S	*	*				106	112.1	50.4	63.7	0	0	0	0	111.8
168	N	27.7	Very low	37.4	Very low	177 Å²	177	138.1 Å²	138.1	95%	0.947	72%	0.716	S	S	*	*			trans	-147.5	145.9	137	-108.6	-3.1	0	0	0	106.5
169	G	37.4	Very low	38.2	Very low	75 Å²	75	135.7 Å²	135.7	77%	0.773	70%	0.701	S	S	*	*			trans	-124	143	-173.9	0	0	0	0	0	111.7
170	E	31.4	Very low	40.3	Very low	201 Å²	201	139.2 Å²	139.2	94%	0.939	71%	0.711	S	S	*	*			trans	-122.4	151.2	166.9	-86.9	168.5	177.2	0	0	109.2
171	K	36.7	Very low	42.4	Very low	197 Å²	197	136.5 Å²	136.5	86%	0.857	69%	0.693	S	S	*	*			trans	-90.4	154.2	-162.3	-72.1	178.2	177.5	175.5	0	112.8	E173	K171-E173 PolarHBondContact O-N 2.94Å
172	N	43.8	Very low	45.3	Very low	163 Å²	163	128.9 Å²	128.9	87%	0.872	66%	0.662	S	S	*	*			trans	-57.3	120.2	162.7	-57.6	-56.1	0	0	0	110.3
173	E	39.5	Very low	48.3	Very low	173 Å²	173	123.8 Å²	123.8	81%	0.808	64%	0.635	S	S	*	*			trans	-127.5	87.3	154.5	-71	-162	165.7	0	0	110.8	K171	K171-E173 PolarHBondContact O-N 2.94Å
174	K	51.6	Low	51	Low	186 Å²	186	120 Å²	120	81%	0.809	62%	0.623	S	S	*	*			trans	-47	123.9	161.4	165.8	-151.9	175.9	-168.4	0	111
175	C	35.2	Very low	54.1	Low	97 Å²	97	115 Å²	115	66%	0.655	59%	0.593	S	S	*	*			trans	-154.4	155.4	149.3	-109.9	0	0	0	0	113.8
176	E	40.1	Very low	56.9	Low	118 Å²	118	114.3 Å²	114.3	55%	0.551	59%	0.588	S	S	*	*			trans	-56.9	170	176.6	-58.7	93.4	-165	0	0	113.7	K178	E176-K178 PolarHBondContact O-N 3.33Å; E176-K178 WeakPolarHBondContact OE2-CE 3.34Å; E176-K178 IonicContact OE2-NZ 3.33Å; E176-K178 PolarHBondContact OE2-NZ 2.91Å
177	T	38.3	Very low	60	Low	112 Å²	112	108.5 Å²	108.5	69%	0.687	56%	0.563	S	S	*	*	S	Bend	trans	-69.1	54.2	167.3	4.4	0	0	0	0	112.6	V118	V118-T177 HydrophobicContact CG1-CG2 4.44Å; V118-T177 HydrophobicContact CG2-CG2 4.18Å
178	K	44.9	Very low	63.1	Low	93 Å²	93	103.6 Å²	103.6	40%	0.404	53%	0.529	S	S	.	.			trans	-66.3	139.3	161.5	-75	162.5	172.7	147.2	0	108.6	E176 K180 E187	E176-K178 PolarHBondContact O-N 3.33Å; E176-K178 WeakPolarHBondContact OE2-CE 3.34Å; E176-K178 IonicContact OE2-NZ 3.33Å; E176-K178 PolarHBondContact OE2-NZ 2.91Å; K178-K180 PolarHBondContact O-N 2.88Å; K178-E187 WeakPolarHBondContact CE-OE1 3.42Å; K178-E187 IonicContact NZ-OE1 2.71Å
179	E	54.7	Low	66.4	Low	93 Å²	93	98.3 Å²	98.3	44%	0.435	50%	0.496	S	S	.	.			trans	-60.3	129.7	164.2	-63.8	-173	-179.5	0	0	108.2	G181 A182 K266	E179-G181 PolarHBondContact O-N 3.46Å; E179-A182 HydrophobicContact CB-CB 3.91Å; E179-A182 WeakPolarHBondContact O-CB 3.34Å; E179-A182 PolarHBondContact O-N 3.34Å; E179-K266 WeakPolarHBondContact OE1-CE 3.14Å; E179-K266 IonicContact OE1-NZ 3.35Å; E179-K266 PolarHBondContact OE1-NZ 3.43Å; E179-K266 VanDerWaalsContact OE2-CE 3.29Å; E179-K266 WeakPolarHBondContact OE2-CE 3.19Å; E179-K266 IonicContact OE2-NZ 2.82Å; E179-K266 PolarHBondContact OE2-NZ 3.49Å
180	K	74.9	Confident	69.3	Low	198 Å²	198	98.3 Å²	98.3	86%	0.861	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	111.1	-164.2	-70.6	-168.2	174.4	-167.4	0	111.3	K178	K178-K180 PolarHBondContact O-N 2.88Å
181	G	89.1	Confident	72.4	Confident	10 Å²	10	90 Å²	90	10%	0.103	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	20.9	-177.7	0	0	0	0	0	114.7	E179 L295 V296	E179-G181 PolarHBondContact O-N 3.46Å; G181-L295 CarbonylContact O-C 3.51Å; G181-L295 WeakPolarHBondContact O-CA 3.22Å; G181-V296 PolarHBondContact O-N 2.85Å
182	A	95.5	Very high	75.1	Confident	9 Å²	9	83.5 Å²	83.5	7%	0.074	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	160.7	170.2	0	0	0	0	0	112	E179 A265 V296 E298	E179-A182 HydrophobicContact CB-CB 3.91Å; E179-A182 WeakPolarHBondContact O-CB 3.34Å; E179-A182 PolarHBondContact O-N 3.34Å; A182-A265 HydrophobicContact CB-CB 3.63Å; A182-V296 CarbonylContact C-O 3.35Å; A182-V296 WeakPolarHBondContact CA-O 3.49Å; A182-E298 HydrophobicContact CB-CG 4.15Å
183	I	97.4	Very high	77.5	Confident	5 Å²	5	79.3 Å²	79.3	3%	0.026	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	135.8	166.8	-172	172.9	0	0	0	110.1	E187 L188 M191 V257 L295 V296 L297 E298	I183-E187 HydrophobicContact CD1-CB 4.08Å; I183-E187 HydrophobicContact CG1-CB 3.63Å; I183-L188 HydrophobicContact CD1-CB 4.03Å; I183-L188 HydrophobicContact CG1-CB 4.41Å; I183-M191 HydrophobicContact CD1-SD 3.49Å; I183-M191 WeakPolarHBondContact CD1-SD 3.33Å; I183-V257 HydrophobicContact CD1-CG2 4.09Å; I183-V257 HydrophobicContact CG2-CG1 3.68Å; I183-V257 HydrophobicContact CG2-CG2 4.07Å; I183-L295 HydrophobicContact CB-CB 4.01Å; I183-L295 HydrophobicContact CB-CD1 4.08Å; I183-L295 HydrophobicContact CD1-CD1 4.21Å; I183-L295 HydrophobicContact CG2-CB 3.86Å; I183-V296 PolarHBondContact N-O 3.32Å; I183-L297 WeakPolarHBondContact O-CA 3.32Å; I183-E298 PolarHBondContact O-N 3.27Å
184	T	97.8	Very high	80.1	Confident	60 Å²	60	74 Å²	74	37%	0.368	37%	0.374	S	S	.	.			trans	-80.3	154.7	174.2	64.7	0	0	0	0	111.7	K186 E187 L188	T184-K186 PolarHBondContact O-N 3.05Å; T184-K186 VanDerWaalsContact O-N 3.12Å; T184-E187 WeakPolarHBondContact CB-OE2 3.37Å; T184-E187 WeakPolarHBondContact CG2-OE2 3.34Å; T184-E187 PolarHBondContact N-OE2 3.36Å; T184-E187 PolarHBondContact O-N 3.14Å; T184-E187 VanDerWaalsContact O-N 3.09Å; T184-E187 WeakPolarHBondContact OG1-CG 3.27Å; T184-E187 PolarHBondContact OG1-N 3.23Å; T184-E187 PolarHBondContact OG1-OE2 3.24Å; T184-L188 PolarHBondContact O-N 2.66Å
185	A	97.5	Very high	82	Confident	4 Å²	4	74.9 Å²	74.9	3%	0.033	38%	0.378	C	S	.	.	H	α-helix	trans	-53.8	-33.3	174.3	0	0	0	0	0	113	Y189 L297 W304 C307 Y308	A185-Y189 WeakPolarHBondContact O-CB 3.26Å; A185-Y189 PolarHBondContact O-N 3.34Å; A185-L297 HydrophobicContact CB-CD1 4.2Å; A185-W304 HydrophobicContact CB-CE3 3.92Å; A185-W304 HydrophobicContact CB-CZ3 4.26Å; A185-W304 WeakPolarHBondContact O-CZ3 3.17Å; A185-C307 HydrophobicContact CB-CB 4.27Å; A185-Y308 HydrophobicContact CB-CD2 4.07Å; A185-Y308 HydrophobicContact CB-CE2 3.98Å; A185-Y308 VanDerWaalsContact O-CE2 3.31Å; A185-Y308 WeakPolarHBondContact O-CE2 3.45Å
186	K	97.3	Very high	84.8	Confident	148 Å²	148	77 Å²	77	64%	0.643	38%	0.383	S	S	*	.	H	α-helix	trans	-68	-43.4	177.1	-178.2	-174.7	173.3	-171.5	0	112.9	T184 T190	T184-K186 PolarHBondContact O-N 3.05Å; T184-K186 VanDerWaalsContact O-N 3.12Å; K186-T190 PolarHBondContact O-N 3.13Å; K186-T190 PolarHBondContact O-OG1 3.44Å
187	E	97.2	Very high	87.4	Confident	57 Å²	57	73.8 Å²	73.8	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-66.3	-44.8	175.3	-71	163.7	115.2	0	0	110.5	K178 I183 T184 Y189 T190 M191	K178-E187 WeakPolarHBondContact CE-OE1 3.42Å; K178-E187 IonicContact NZ-OE1 2.71Å; I183-E187 HydrophobicContact CD1-CB 4.08Å; I183-E187 HydrophobicContact CG1-CB 3.63Å; T184-E187 WeakPolarHBondContact CB-OE2 3.37Å; T184-E187 WeakPolarHBondContact CG2-OE2 3.34Å; T184-E187 PolarHBondContact N-OE2 3.36Å; T184-E187 PolarHBondContact O-N 3.14Å; T184-E187 VanDerWaalsContact O-N 3.09Å; T184-E187 WeakPolarHBondContact OG1-CG 3.27Å; T184-E187 PolarHBondContact OG1-N 3.23Å; T184-E187 PolarHBondContact OG1-OE2 3.24Å; E187-Y189 PolarHBondContact O-N 2.61Å; E187-T190 WeakPolarHBondContact O-CB 3.37Å; E187-T190 PolarHBondContact O-N 3.19Å; E187-T190 VanDerWaalsContact O-N 3.12Å; E187-M191 WeakPolarHBondContact O-CG 3.43Å; E187-M191 PolarHBondContact O-N 3.01Å
188	L	97.5	Very high	90.1	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-56.9	-48.8	175.4	176	58.4	0	0	0	111.5	I183 T184 T190 M191 M192 L199 I201 I215 V257 L297 W304	I183-L188 HydrophobicContact CD1-CB 4.03Å; I183-L188 HydrophobicContact CG1-CB 4.41Å; T184-L188 PolarHBondContact O-N 2.66Å; L188-T190 VanDerWaalsContact C-N 3.3Å; L188-T190 PolarHBondContact O-N 3.02Å; L188-M191 PolarHBondContact O-N 2.61Å; L188-M192 HydrophobicContact CD1-CG 4.24Å; L188-M192 HydrophobicContact CD1-SD 4.37Å; L188-M192 HydrophobicContact CG-SD 4.17Å; L188-M192 WeakPolarHBondContact O-CG 3.26Å; L188-M192 PolarHBondContact O-N 2.65Å; L188-L199 HydrophobicContact CD1-CD2 3.77Å; L188-I201 HydrophobicContact CD1-CD1 3.85Å; L188-I201 HydrophobicContact CD1-CG1 4.02Å; L188-I201 HydrophobicContact CD2-CD1 4.39Å; L188-I201 HydrophobicContact CG-CD1 4.45Å; L188-I215 HydrophobicContact CD2-CD1 4.36Å; L188-V257 HydrophobicContact CD1-CB 4.38Å; L188-V257 HydrophobicContact CD1-CG1 4.25Å; L188-V257 HydrophobicContact CD1-CG2 4.19Å; L188-V257 HydrophobicContact CD2-CG1 4.3Å; L188-L297 HydrophobicContact CB-CD1 4.38Å; L188-L297 HydrophobicContact CD2-CD1 3.79Å; L188-L297 HydrophobicContact CD2-CD2 3.81Å; L188-L297 HydrophobicContact CD2-CG 4.33Å; L188-W304 HydrophobicContact CB-CZ3 4.05Å; L188-W304 HydrophobicContact CD2-CE3 3.93Å; L188-W304 HydrophobicContact CD2-CH2 4.25Å; L188-W304 HydrophobicContact CD2-CZ3 3.63Å; L188-W304 HydrophobicContact CG-CH2 4.15Å; L188-W304 HydrophobicContact CG-CZ3 3.76Å
189	Y	97.3	Very high	92.6	Very high	66 Å²	66	67.7 Å²	67.7	26%	0.259	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-43.3	175.2	170.5	-106.8	0	0	0	112.1	A185 E187 M191 M192 T193 Y308 Y311	A185-Y189 WeakPolarHBondContact O-CB 3.26Å; A185-Y189 PolarHBondContact O-N 3.34Å; E187-Y189 PolarHBondContact O-N 2.61Å; Y189-M191 PolarHBondContact O-N 2.71Å; Y189-M192 PolarHBondContact O-N 3.32Å; Y189-T193 HydrophobicContact CD2-CG2 4.29Å; Y189-T193 HydrophobicContact CE1-CG2 4.28Å; Y189-T193 HydrophobicContact CE2-CG2 3.65Å; Y189-T193 WeakPolarHBondContact O-CG2 3.43Å; Y189-T193 PolarHBondContact O-N 3.33Å; Y189-T193 VanDerWaalsContact O-N 3.09Å; Y189-T193 PolarHBondContact O-OG1 2.65Å; Y189-Y308 AromaticContact CD1-CE1 3.71Å; Y189-Y308 HydrophobicContact CD1-CE1 3.71Å; Y189-Y308 AromaticContact CD1-CZ 3.97Å; Y189-Y308 AromaticContact CD2-CD1 3.96Å; Y189-Y308 HydrophobicContact CD2-CD1 3.96Å; Y189-Y308 AromaticContact CD2-CE1 3.96Å; Y189-Y308 HydrophobicContact CD2-CE1 3.96Å; Y189-Y308 HydrophobicContact CE1-CE1 4.3Å; Y189-Y308 AromaticContact CG-CD1 3.96Å; Y189-Y308 HydrophobicContact CG-CD1 3.96Å; Y189-Y308 AromaticContact CG-CE1 3.51Å; Y189-Y308 HydrophobicContact CG-CE1 3.51Å; Y189-Y308 HydrophobicContact CG-CE2 4.45Å; Y189-Y308 AromaticContact CG-CZ 3.81Å; Y189-Y311 HydrophobicContact CD2-CD2 4.16Å; Y189-Y311 AromaticContact CD2-CE2 3.95Å; Y189-Y311 HydrophobicContact CD2-CE2 3.95Å; Y189-Y311 HydrophobicContact CE2-CD2 4.07Å; Y189-Y311 HydrophobicContact CE2-CE1 4.29Å; Y189-Y311 AromaticContact CE2-CE2 3.39Å; Y189-Y311 HydrophobicContact CE2-CE2 3.39Å; Y189-Y311 AromaticContact CE2-CZ 3.55Å
190	T	97.3	Very high	94.6	Very high	75 Å²	75	63.9 Å²	63.9	46%	0.46	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-45.3	178	-57	0	0	0	0	110.8	K186 E187 L188 M192 T193 D194	K186-T190 PolarHBondContact O-N 3.13Å; K186-T190 PolarHBondContact O-OG1 3.44Å; E187-T190 WeakPolarHBondContact O-CB 3.37Å; E187-T190 PolarHBondContact O-N 3.19Å; E187-T190 VanDerWaalsContact O-N 3.12Å; L188-T190 VanDerWaalsContact C-N 3.3Å; L188-T190 PolarHBondContact O-N 3.02Å; T190-M192 PolarHBondContact O-N 2.67Å; T190-T193 PolarHBondContact O-N 2.87Å; T190-T193 VanDerWaalsContact O-N 3.14Å; T190-T193 PolarHBondContact O-OG1 3.44Å; T190-D194 PolarHBondContact O-N 2.99Å; T190-D194 VanDerWaalsContact O-N 3.12Å
191	M	96.2	Very high	95.7	Very high	27 Å²	27	54.8 Å²	54.8	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-33.3	176.6	-67.4	172.5	67	0	0	113.3	I183 E187 L188 Y189 T193 I197 L199 Y255	I183-M191 HydrophobicContact CD1-SD 3.49Å; I183-M191 WeakPolarHBondContact CD1-SD 3.33Å; E187-M191 WeakPolarHBondContact O-CG 3.43Å; E187-M191 PolarHBondContact O-N 3.01Å; L188-M191 PolarHBondContact O-N 2.61Å; Y189-M191 PolarHBondContact O-N 2.71Å; M191-T193 VanDerWaalsContact C-N 3.29Å; M191-T193 PolarHBondContact O-N 3.45Å; M191-I197 HydrophobicContact CB-CD1 4.42Å; M191-I197 HydrophobicContact CB-CG2 4.27Å; M191-I197 HydrophobicContact CE-CG2 3.88Å; M191-I197 HydrophobicContact CG-CD1 3.97Å; M191-I197 HydrophobicContact CG-CG2 4.39Å; M191-L199 HydrophobicContact CB-CD2 4.11Å; M191-L199 HydrophobicContact CE-CD1 4.48Å; M191-Y255 HydrophobicContact CE-CD1 4.01Å; M191-Y255 HydrophobicContact CE-CD2 3.36Å; M191-Y255 HydrophobicContact CE-CE2 3.99Å; M191-Y255 HydrophobicContact CE-CG 3.37Å
192	M	95.1	Very high	96.2	Very high	60 Å²	60	54.3 Å²	54.3	30%	0.296	28%	0.277	S	S	.	.	H	α-helix	trans	-68	-27.8	172.5	-70.8	174.9	75.9	0	0	112.8	L188 Y189 T190 L199 I201 I215 W304	L188-M192 HydrophobicContact CD1-CG 4.24Å; L188-M192 HydrophobicContact CD1-SD 4.37Å; L188-M192 HydrophobicContact CG-SD 4.17Å; L188-M192 WeakPolarHBondContact O-CG 3.26Å; L188-M192 PolarHBondContact O-N 2.65Å; Y189-M192 PolarHBondContact O-N 3.32Å; T190-M192 PolarHBondContact O-N 2.67Å; M192-L199 HydrophobicContact CG-CD2 3.97Å; M192-I201 HydrophobicContact CE-CD1 3.96Å; M192-I201 HydrophobicContact CG-CD1 3.99Å; M192-I201 HydrophobicContact SD-CD1 3.62Å; M192-I215 HydrophobicContact CE-CG2 3.68Å; M192-I215 HydrophobicContact SD-CG2 4.24Å; M192-W304 HydrophobicContact CE-CZ2 4.45Å; M192-W304 HydrophobicContact SD-CH2 3.57Å; M192-W304 VanDerWaalsContact SD-CH2 3.57Å; M192-W304 HydrophobicContact SD-CZ2 3.85Å
193	T	93.8	Very high	96.3	Very high	74 Å²	74	54 Å²	54	45%	0.454	27%	0.274	S	S	.	.	H	α-helix	trans	-86.5	-22.7	178.1	57.7	0	0	0	0	114.4	Y189 T190 M191 K195	Y189-T193 HydrophobicContact CD2-CG2 4.29Å; Y189-T193 HydrophobicContact CE1-CG2 4.28Å; Y189-T193 HydrophobicContact CE2-CG2 3.65Å; Y189-T193 WeakPolarHBondContact O-CG2 3.43Å; Y189-T193 PolarHBondContact O-N 3.33Å; Y189-T193 VanDerWaalsContact O-N 3.09Å; Y189-T193 PolarHBondContact O-OG1 2.65Å; T190-T193 PolarHBondContact O-N 2.87Å; T190-T193 VanDerWaalsContact O-N 3.14Å; T190-T193 PolarHBondContact O-OG1 3.44Å; M191-T193 VanDerWaalsContact C-N 3.29Å; M191-T193 PolarHBondContact O-N 3.45Å; T193-K195 PolarHBondContact O-N 3.06Å
194	D	94.4	Very high	96.3	Very high	61 Å²	61	53.8 Å²	53.8	33%	0.326	27%	0.273	S	S	.	.			trans	-86.7	109.8	-178.8	-169.7	-8.6	0	0	0	112	T190 N196 I197	T190-D194 PolarHBondContact O-N 2.99Å; T190-D194 VanDerWaalsContact O-N 3.12Å; D194-N196 PolarHBondContact O-N 3.1Å; D194-N196 VanDerWaalsContact O-N 3.14Å; D194-N196 WeakPolarHBondContact OD1-CB 3.29Å; D194-N196 PolarHBondContact OD1-N 3.3Å; D194-N196 PolarHBondContact OD1-ND2 3.03Å; D194-I197 HydrophobicContact CB-CB 4.47Å; D194-I197 HydrophobicContact CB-CD1 4Å; D194-I197 HydrophobicContact CB-CG1 4.06Å; D194-I197 PolarHBondContact O-N 3.02Å; D194-I197 VanDerWaalsContact O-N 3.09Å
195	K	91.6	Very high	96.2	Very high	206 Å²	206	51 Å²	51	90%	0.896	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.4	179.2	-61.2	-178.2	-178.1	178.9	0	114.2	T193	T193-K195 PolarHBondContact O-N 3.06Å
196	N	93.9	Very high	96.2	Very high	142 Å²	142	56 Å²	56	76%	0.759	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-21	175.3	-55.5	-73.7	0	0	0	112.1	D194	D194-N196 PolarHBondContact O-N 3.1Å; D194-N196 VanDerWaalsContact O-N 3.14Å; D194-N196 WeakPolarHBondContact OD1-CB 3.29Å; D194-N196 PolarHBondContact OD1-N 3.3Å; D194-N196 PolarHBondContact OD1-ND2 3.03Å
197	I	94	Very high	96.1	Very high	49 Å²	49	51.7 Å²	51.7	25%	0.251	26%	0.257	S	S	.	.	S	Bend	trans	-93.6	125.7	-176.6	-59.6	-178.3	0	0	0	109.2	M191 D194 Y255	M191-I197 HydrophobicContact CB-CD1 4.42Å; M191-I197 HydrophobicContact CB-CG2 4.27Å; M191-I197 HydrophobicContact CE-CG2 3.88Å; M191-I197 HydrophobicContact CG-CD1 3.97Å; M191-I197 HydrophobicContact CG-CG2 4.39Å; D194-I197 HydrophobicContact CB-CB 4.47Å; D194-I197 HydrophobicContact CB-CD1 4Å; D194-I197 HydrophobicContact CB-CG1 4.06Å; D194-I197 PolarHBondContact O-N 3.02Å; D194-I197 VanDerWaalsContact O-N 3.09Å; I197-Y255 HydrophobicContact CG2-CD2 3.75Å; I197-Y255 HydrophobicContact CG2-CE2 4.07Å
198	S	95.4	Very high	96	Very high	40 Å²	40	54.5 Å²	54.5	28%	0.28	27%	0.27	S	S	.	.			trans	-96.9	119	174.4	56.6	0	0	0	0	110.3	V253 E254 Y255	S198-V253 WeakPolarHBondContact OG-CA 3.45Å; S198-E254 PolarHBondContact O-N 3.22Å; S198-E254 WeakPolarHBondContact OG-CB 3.36Å; S198-E254 PolarHBondContact OG-N 3.44Å; S198-Y255 PolarHBondContact O-N 3.35Å
199	L	96.3	Very high	95.9	Very high	37 Å²	37	55.5 Å²	55.5	19%	0.194	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.5	-168.2	169.3	65.4	0	0	0	110.7	L188 M191 M192 I201 Y255 V257	L188-L199 HydrophobicContact CD1-CD2 3.77Å; M191-L199 HydrophobicContact CB-CD2 4.11Å; M191-L199 HydrophobicContact CE-CD1 4.48Å; M192-L199 HydrophobicContact CG-CD2 3.97Å; L199-I201 HydrophobicContact CD1-CG1 4.47Å; L199-I201 HydrophobicContact CD2-CD1 4.45Å; L199-I201 HydrophobicContact CD2-CG1 4.15Å; L199-I201 HydrophobicContact CG-CG1 4.21Å; L199-Y255 WeakPolarHBondContact CA-O 3.37Å; L199-V257 HydrophobicContact CD1-CB 4.18Å; L199-V257 HydrophobicContact CD1-CG2 3.58Å
200	I	97.8	Very high	95.9	Very high	14 Å²	14	54 Å²	54	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.8	160.5	-72.3	165.5	0	0	0	108.8	M202 L219 T246 V253 Y255 V256 V257	I200-M202 HydrophobicContact CG2-CE 3.9Å; I200-M202 HydrophobicContact CG2-CG 3.88Å; I200-L219 HydrophobicContact CG2-CB 4.22Å; I200-L219 HydrophobicContact CG2-CD2 4.05Å; I200-T246 HydrophobicContact CD1-CG2 3.92Å; I200-T246 WeakPolarHBondContact CD1-O 3.43Å; I200-T246 HydrophobicContact CG1-CG2 4.03Å; I200-T246 HydrophobicContact CG2-CG2 4.27Å; I200-V253 HydrophobicContact CB-CG2 4.37Å; I200-V253 HydrophobicContact CD1-CG1 3.91Å; I200-V253 HydrophobicContact CD1-CG2 3.86Å; I200-V253 HydrophobicContact CG1-CG1 4.01Å; I200-V253 HydrophobicContact CG1-CG2 4.08Å; I200-Y255 PolarHBondContact N-O 2.89Å; I200-V256 WeakPolarHBondContact O-CA 3.31Å; I200-V257 PolarHBondContact O-N 3.25Å
201	I	98.1	Very high	95.8	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.036	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.2	171.7	-54	173.5	0	0	0	107.4	L188 M192 L199 I215 S218 L219 V257 L259	L188-I201 HydrophobicContact CD1-CD1 3.85Å; L188-I201 HydrophobicContact CD1-CG1 4.02Å; L188-I201 HydrophobicContact CD2-CD1 4.39Å; L188-I201 HydrophobicContact CG-CD1 4.45Å; M192-I201 HydrophobicContact CE-CD1 3.96Å; M192-I201 HydrophobicContact CG-CD1 3.99Å; M192-I201 HydrophobicContact SD-CD1 3.62Å; L199-I201 HydrophobicContact CD1-CG1 4.47Å; L199-I201 HydrophobicContact CD2-CD1 4.45Å; L199-I201 HydrophobicContact CD2-CG1 4.15Å; L199-I201 HydrophobicContact CG-CG1 4.21Å; I201-I215 HydrophobicContact CD1-CG2 4Å; I201-I215 HydrophobicContact CG2-CD1 4.35Å; I201-S218 CarbonylContact O-C 3.54Å; I201-L219 VanDerWaalsContact O-CB 3.3Å; I201-L219 WeakPolarHBondContact O-CB 3.33Å; I201-L219 PolarHBondContact O-N 2.8Å; I201-V257 CarbonylContact C-O 3.56Å; I201-V257 WeakPolarHBondContact CA-O 3.48Å; I201-L259 HydrophobicContact CG2-CD2 3.66Å
202	M	98.3	Very high	95.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.9	178.3	-58.4	-170.9	176.4	0	0	109.9	I200 L219 V221 W247 R250 V256 V257 L258 L259 L281	I200-M202 HydrophobicContact CG2-CE 3.9Å; I200-M202 HydrophobicContact CG2-CG 3.88Å; M202-L219 WeakPolarHBondContact CA-O 3.45Å; M202-L219 HydrophobicContact CE-CD2 4.09Å; M202-L219 HydrophobicContact CG-CB 4.5Å; M202-L219 HydrophobicContact CG-CD2 4.17Å; M202-V221 HydrophobicContact CB-CG2 3.86Å; M202-V221 HydrophobicContact CG-CG2 4.12Å; M202-V221 HydrophobicContact SD-CG2 4.19Å; M202-W247 HydrophobicContact CE-CE3 3.88Å; M202-W247 HydrophobicContact CE-CZ3 3.94Å; M202-W247 HydrophobicContact SD-CE3 4.12Å; M202-W247 HydrophobicContact SD-CZ3 3.7Å; M202-R250 HydrophobicContact CE-CB 4.2Å; M202-V256 HydrophobicContact CE-CG1 3.75Å; M202-V256 HydrophobicContact CE-CG2 4.48Å; M202-V256 HydrophobicContact CG-CG1 4.06Å; M202-V256 HydrophobicContact SD-CG1 3.77Å; M202-V257 PolarHBondContact N-O 3.13Å; M202-L258 HydrophobicContact CB-CD2 3.82Å; M202-L258 HydrophobicContact CG-CD2 4.19Å; M202-L258 WeakPolarHBondContact O-CA 3.39Å; M202-L258 HydrophobicContact SD-CD2 4Å; M202-L259 PolarHBondContact O-N 2.89Å; M202-L281 HydrophobicContact CE-CD2 4.38Å; M202-L281 HydrophobicContact SD-CD1 3.8Å; M202-L281 HydrophobicContact SD-CD2 4.47Å
203	D	98	Very high	95.9	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	114.6	179.3	-165.5	-33.5	0	0	0	109.4	R205 Y210 L219 V221 L259	D203-R205 WeakPolarHBondContact OD1-CB 3.36Å; D203-R205 VanDerWaalsContact OD1-CG 3.28Å; D203-R205 WeakPolarHBondContact OD1-CG 3.33Å; D203-R205 IonicContact OD1-CZ 2.67Å; D203-R205 PolarHBondContact OD1-N 2.92Å; D203-R205 IonicContact OD1-NE 3.02Å; D203-R205 PolarHBondContact OD1-NE 3.35Å; D203-R205 IonicContact OD1-NH2 2.66Å; D203-R205 IonicContact OD2-CZ 3.32Å; D203-R205 IonicContact OD2-NE 2.97Å; D203-R205 PolarHBondContact OD2-NE 2.9Å; D203-R205 IonicContact OD2-NH2 2.76Å; D203-R205 PolarHBondContact OD2-NH2 3.21Å; D203-Y210 HydrophobicContact CB-CD2 3.67Å; D203-Y210 HydrophobicContact CB-CE2 3.83Å; D203-L219 PolarHBondContact N-O 2.66Å; D203-V221 CarbonylContact O-C 3.52Å; D203-V221 PolarHBondContact O-N 2.91Å; D203-L259 HydrophobicContact CB-CD1 4.18Å; D203-L259 HydrophobicContact CB-CG 4.46Å
204	A	97.5	Very high	96	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.008	26%	0.256	C	S	.	.			trans	-102.1	18.4	-172.7	0	0	0	0	0	113.6	V221 I226 L259 T273 L274 L277	A204-V221 WeakPolarHBondContact CA-O 3.11Å; A204-I226 HydrophobicContact CB-CD1 4.18Å; A204-L259 WeakPolarHBondContact CB-O 3.3Å; A204-L259 PolarHBondContact N-O 3.4Å; A204-T273 HydrophobicContact CB-CG2 4.21Å; A204-L274 HydrophobicContact CB-CD2 3.76Å; A204-L277 HydrophobicContact CB-CD2 4.01Å
205	R	96.6	Very high	96.2	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.011	24%	0.24	C	C	.	.	S	Bend	trans	-77.6	-176.4	173	-59.2	178.2	-65.3	132	6.2	110.8	D203 D209 S213 P222 E223 D260 W261	D203-R205 WeakPolarHBondContact OD1-CB 3.36Å; D203-R205 VanDerWaalsContact OD1-CG 3.28Å; D203-R205 WeakPolarHBondContact OD1-CG 3.33Å; D203-R205 IonicContact OD1-CZ 2.67Å; D203-R205 PolarHBondContact OD1-N 2.92Å; D203-R205 IonicContact OD1-NE 3.02Å; D203-R205 PolarHBondContact OD1-NE 3.35Å; D203-R205 IonicContact OD1-NH2 2.66Å; D203-R205 IonicContact OD2-CZ 3.32Å; D203-R205 IonicContact OD2-NE 2.97Å; D203-R205 PolarHBondContact OD2-NE 2.9Å; D203-R205 IonicContact OD2-NH2 2.76Å; D203-R205 PolarHBondContact OD2-NH2 3.21Å; R205-D209 HydrophobicContact CB-CB 3.88Å; R205-D209 PolarHBondContact NH1-O 3Å; R205-D209 PolarHBondContact NH2-O 3.1Å; R205-S213 PolarHBondContact NH1-O 2.66Å; R205-S213 PolarHBondContact NH2-O 3.48Å; R205-P222 WeakPolarHBondContact O-CA 3.48Å; R205-E223 PolarHBondContact O-N 2.75Å; R205-D260 HydrophobicContact CG-CB 4.3Å; R205-W261 HydrophobicContact CG-CG 4.15Å; R205-W261 VanDerWaalsContact NH1-CZ2 3.27Å
206	R	96.2	Very high	96.4	Very high	108 Å²	108	43.1 Å²	43.1	41%	0.408	21%	0.214	S	C	.	.			trans	-63.8	156.1	173.5	-68.6	-174.8	-173.8	90.5	32	111.7	Q208 D209 Y210 E223 E224	R206-Q208 PolarHBondContact O-N 3.46Å; R206-D209 HydrophobicContact CB-CB 4.27Å; R206-D209 PolarHBondContact N-OD2 2.76Å; R206-D209 PolarHBondContact O-N 3.47Å; R206-Y210 PolarHBondContact O-N 3.38Å; R206-Y210 VanDerWaalsContact O-N 3.11Å; R206-E223 HydrophobicContact CG-CG 3.74Å; R206-E223 WeakPolarHBondContact CG-OE1 3.43Å; R206-E223 IonicContact CZ-OE1 3.66Å; R206-E223 IonicContact NE-OE1 3.23Å; R206-E223 PolarHBondContact NE-OE1 3.28Å; R206-E223 IonicContact NH2-OE1 2.58Å; R206-E223 PolarHBondContact NH2-OE1 3.35Å; R206-E223 IonicContact NH2-OE2 2.67Å; R206-E223 PolarHBondContact NH2-OE2 3.04Å; R206-E224 WeakPolarHBondContact CB-OE1 3.03Å
207	M	94.9	Very high	96.3	Very high	57 Å²	57	45.4 Å²	45.4	28%	0.281	22%	0.219	S	C	.	.	H	α-helix	trans	-52.4	-43.8	169.4	-177.1	59.6	59.1	0	0	111.8	Y210 Q211 P222 E224 P240	M207-Y210 PolarHBondContact O-N 2.87Å; M207-Q211 WeakPolarHBondContact O-CG 3.27Å; M207-Q211 PolarHBondContact O-N 3.36Å; M207-Q211 VanDerWaalsContact O-N 3.17Å; M207-P222 HydrophobicContact CB-CB 4.4Å; M207-P222 HydrophobicContact CE-CB 4.03Å; M207-P222 HydrophobicContact CE-CG 3.66Å; M207-E224 PolarHBondContact N-OE1 3.14Å; M207-E224 PolarHBondContact N-OE2 3.12Å; M207-P240 HydrophobicContact CE-CB 4.43Å; M207-P240 HydrophobicContact CE-CG 3.95Å
208	Q	94.9	Very high	96.4	Very high	116 Å²	116	43.9 Å²	43.9	54%	0.542	21%	0.213	S	C	.	.	H	α-helix	trans	-63.4	-48.5	178	-171	64.1	51	0	0	112.2	R206 Y210 Q211 D212	R206-Q208 PolarHBondContact O-N 3.46Å; Q208-Y210 PolarHBondContact O-N 3.13Å; Q208-Y210 VanDerWaalsContact O-N 3.16Å; Q208-Q211 PolarHBondContact O-N 3.47Å; Q208-D212 PolarHBondContact NE2-OD1 3.08Å; Q208-D212 PolarHBondContact O-N 2.86Å
209	D	96.2	Very high	96.5	Very high	21 Å²	21	42.1 Å²	42.1	11%	0.112	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-32.1	-178.9	-58.4	-12.3	0	0	0	112.3	R205 R206 S213 W261	R205-D209 HydrophobicContact CB-CB 3.88Å; R205-D209 PolarHBondContact NH1-O 3Å; R205-D209 PolarHBondContact NH2-O 3.1Å; R206-D209 HydrophobicContact CB-CB 4.27Å; R206-D209 PolarHBondContact N-OD2 2.76Å; R206-D209 PolarHBondContact O-N 3.47Å; D209-S213 PolarHBondContact O-N 3.03Å; D209-W261 HydrophobicContact CB-CZ2 3.87Å; D209-W261 VanDerWaalsContact CG-NE1 3.32Å; D209-W261 PolarHBondContact OD2-NE1 3.48Å
210	Y	96.5	Very high	96.5	Very high	34 Å²	34	40.5 Å²	40.5	13%	0.133	19%	0.192	C	C	.	.	H	α-helix	trans	-73.8	-42.1	175.2	-176.2	-88.3	0	0	0	112.9	D203 R206 M207 Q208 S213 C214 S218	D203-Y210 HydrophobicContact CB-CD2 3.67Å; D203-Y210 HydrophobicContact CB-CE2 3.83Å; R206-Y210 PolarHBondContact O-N 3.38Å; R206-Y210 VanDerWaalsContact O-N 3.11Å; M207-Y210 PolarHBondContact O-N 2.87Å; Q208-Y210 PolarHBondContact O-N 3.13Å; Q208-Y210 VanDerWaalsContact O-N 3.16Å; Y210-S213 CarbonylContact O-C 3.52Å; Y210-C214 HydrophobicContact CD1-CB 4.38Å; Y210-C214 HydrophobicContact CD2-CB 3.56Å; Y210-C214 HydrophobicContact CE1-CB 4.31Å; Y210-C214 HydrophobicContact CE2-CB 3.49Å; Y210-C214 VanDerWaalsContact CE2-CB 3.49Å; Y210-C214 HydrophobicContact CG-CB 4.03Å; Y210-C214 WeakPolarHBondContact O-CB 3.44Å; Y210-S218 PolarHBondContact OH-O 3.44Å; Y210-S218 VanDerWaalsContact OH-O 3.14Å
211	Q	95.3	Very high	96.5	Very high	126 Å²	126	39.8 Å²	39.8	59%	0.589	19%	0.189	S	C	*	.	H	α-helix	trans	-68.6	-36.3	176.8	-62.4	-60.9	-29.5	0	0	111.7	M207 Q208 S213	M207-Q211 WeakPolarHBondContact O-CG 3.27Å; M207-Q211 PolarHBondContact O-N 3.36Å; M207-Q211 VanDerWaalsContact O-N 3.17Å; Q208-Q211 PolarHBondContact O-N 3.47Å; Q211-S213 VanDerWaalsContact C-N 3.35Å
212	D	96.1	Very high	96.4	Very high	73 Å²	73	39.8 Å²	39.8	39%	0.39	19%	0.189	S	C	.	.	H	α-helix	trans	-65.5	-37	177.7	-73.2	-3.1	0	0	0	111.9	Q208 N314 V317	Q208-D212 PolarHBondContact NE2-OD1 3.08Å; Q208-D212 PolarHBondContact O-N 2.86Å; D212-N314 WeakPolarHBondContact O-CB 3.26Å; D212-N314 PolarHBondContact O-ND2 2.95Å; D212-V317 HydrophobicContact CB-CG2 4.31Å
213	S	97.6	Very high	96.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.202	C	C	.	.			trans	-170.9	136	172.1	-169.7	0	0	0	0	111.8	R205 D209 Y210 Q211 Y301 T313 N314	R205-S213 PolarHBondContact NH1-O 2.66Å; R205-S213 PolarHBondContact NH2-O 3.48Å; D209-S213 PolarHBondContact O-N 3.03Å; Y210-S213 CarbonylContact O-C 3.52Å; Q211-S213 VanDerWaalsContact C-N 3.35Å; S213-Y301 PolarHBondContact OG-OH 2.93Å; S213-T313 WeakPolarHBondContact CA-OG1 3.24Å; S213-N314 WeakPolarHBondContact CB-O 3.28Å; S213-N314 VanDerWaalsContact OG-C 3.28Å; S213-N314 PolarHBondContact OG-N 2.96Å; S213-N314 PolarHBondContact OG-O 3.47Å
214	C	97	Very high	96.1	Very high	12 Å²	12	47.9 Å²	47.9	8%	0.081	23%	0.227	C	C	.	.			trans	-142.9	168.8	174.2	65.6	0	0	0	0	112.8	Y210 Y301 T312 T313	Y210-C214 HydrophobicContact CD1-CB 4.38Å; Y210-C214 HydrophobicContact CD2-CB 3.56Å; Y210-C214 HydrophobicContact CE1-CB 4.31Å; Y210-C214 HydrophobicContact CE2-CB 3.49Å; Y210-C214 VanDerWaalsContact CE2-CB 3.49Å; Y210-C214 HydrophobicContact CG-CB 4.03Å; Y210-C214 WeakPolarHBondContact O-CB 3.44Å; C214-Y301 VanDerWaalsContact CA-OH 3.27Å; C214-Y301 WeakPolarHBondContact CA-OH 3.37Å; C214-Y301 PolarHBondContact N-OH 3.23Å; C214-Y301 VanDerWaalsContact N-OH 3.14Å; C214-Y301 PolarHBondContact O-OH 3.41Å; C214-T312 CarbonylContact O-C 3.58Å; C214-T312 WeakPolarHBondContact O-CA 3.42Å; C214-T312 WeakPolarHBondContact O-CB 3.43Å; C214-T313 PolarHBondContact N-OG1 3.46Å; C214-T313 PolarHBondContact O-N 2.83Å
215	I	97.9	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-69.9	137.7	172.7	-55.9	-170.4	0	0	0	109.3	L188 M192 I201 H217 S218 L259 L297 Y301 W304	L188-I215 HydrophobicContact CD2-CD1 4.36Å; M192-I215 HydrophobicContact CE-CG2 3.68Å; M192-I215 HydrophobicContact SD-CG2 4.24Å; I201-I215 HydrophobicContact CD1-CG2 4Å; I201-I215 HydrophobicContact CG2-CD1 4.35Å; I215-H217 PolarHBondContact O-N 2.83Å; I215-S218 VanDerWaalsContact O-CB 3.31Å; I215-S218 WeakPolarHBondContact O-CB 3.2Å; I215-S218 PolarHBondContact O-N 3.43Å; I215-S218 VanDerWaalsContact O-N 3.07Å; I215-S218 PolarHBondContact O-OG 3.02Å; I215-L259 HydrophobicContact CD1-CD2 3.44Å; I215-L259 VanDerWaalsContact CD1-CD2 3.44Å; I215-L259 HydrophobicContact CG1-CD2 4.16Å; I215-L297 HydrophobicContact CD1-CD2 4.35Å; I215-Y301 HydrophobicContact CD1-CD2 4.5Å; I215-Y301 HydrophobicContact CG1-CD2 3.95Å; I215-Y301 HydrophobicContact CG1-CE2 3.59Å; I215-W304 HydrophobicContact CD1-CB 4.41Å; I215-W304 HydrophobicContact CD1-CD2 3.62Å; I215-W304 HydrophobicContact CD1-CE3 4.24Å; I215-W304 HydrophobicContact CD1-CG 3.67Å; I215-W304 HydrophobicContact CD1-CZ2 4.32Å; I215-W304 HydrophobicContact CG1-CD2 4.34Å; I215-W304 HydrophobicContact CG1-CG 4.09Å; I215-W304 HydrophobicContact CG2-CZ2 4.06Å
216	L	95.3	Very high	95.9	Very high	64 Å²	64	48.6 Å²	48.6	34%	0.335	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	130.5	176.2	-63	177	0	0	0	111.2	S218 Y311 T313	L216-S218 PolarHBondContact O-N 3.13Å; L216-Y311 PolarHBondContact N-O 3.29Å; L216-Y311 VanDerWaalsContact N-O 3.1Å; L216-T313 HydrophobicContact CD2-CG2 3.92Å
217	H	92.3	Very high	95.8	Very high	190 Å²	190	45.7 Å²	45.7	88%	0.88	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	21.2	-175.9	-47.5	-68.9	0	0	0	115.8	I215	I215-H217 PolarHBondContact O-N 2.83Å
218	S	96.3	Very high	95.7	Very high	17 Å²	17	47.3 Å²	47.3	12%	0.119	24%	0.242	C	C	.	.			trans	-75.7	172.9	166.9	63.2	0	0	0	0	113.1	I201 Y210 I215 L216	I201-S218 CarbonylContact O-C 3.54Å; Y210-S218 PolarHBondContact OH-O 3.44Å; Y210-S218 VanDerWaalsContact OH-O 3.14Å; I215-S218 VanDerWaalsContact O-CB 3.31Å; I215-S218 WeakPolarHBondContact O-CB 3.2Å; I215-S218 PolarHBondContact O-N 3.43Å; I215-S218 VanDerWaalsContact O-N 3.07Å; I215-S218 PolarHBondContact O-OG 3.02Å; L216-S218 PolarHBondContact O-N 3.13Å
219	L	97.1	Very high	95.5	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.4	-178.6	-177.6	61.8	0	0	0	109.8	I200 I201 M202 D203 V221 S243 T246 W247	I200-L219 HydrophobicContact CG2-CB 4.22Å; I200-L219 HydrophobicContact CG2-CD2 4.05Å; I201-L219 VanDerWaalsContact O-CB 3.3Å; I201-L219 WeakPolarHBondContact O-CB 3.33Å; I201-L219 PolarHBondContact O-N 2.8Å; M202-L219 WeakPolarHBondContact CA-O 3.45Å; M202-L219 HydrophobicContact CE-CD2 4.09Å; M202-L219 HydrophobicContact CG-CB 4.5Å; M202-L219 HydrophobicContact CG-CD2 4.17Å; D203-L219 PolarHBondContact N-O 2.66Å; L219-V221 HydrophobicContact CD2-CG2 4.18Å; L219-V221 HydrophobicContact CG-CG2 4.07Å; L219-V221 PolarHBondContact O-N 3Å; L219-S243 WeakPolarHBondContact CD1-O 3.37Å; L219-T246 HydrophobicContact CB-CG2 4.45Å; L219-T246 HydrophobicContact CD1-CG2 4.02Å; L219-T246 HydrophobicContact CD2-CG2 4.12Å; L219-T246 HydrophobicContact CG-CG2 4.45Å; L219-W247 HydrophobicContact CD2-CB 4.22Å; L219-W247 HydrophobicContact CD2-CE3 4.15Å
220	S	97.3	Very high	95.4	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.7	173.1	-168.1	0	0	0	0	110.4	S243	S220-S243 PolarHBondContact O-OG 2.87Å
221	V	97.5	Very high	95.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.255	C	S	.	.			trans	-130.2	71.2	173.9	-169.8	0	0	0	0	107.4	M202 D203 A204 L219 I226 I235 L239 W247 L277	M202-V221 HydrophobicContact CB-CG2 3.86Å; M202-V221 HydrophobicContact CG-CG2 4.12Å; M202-V221 HydrophobicContact SD-CG2 4.19Å; D203-V221 CarbonylContact O-C 3.52Å; D203-V221 PolarHBondContact O-N 2.91Å; A204-V221 WeakPolarHBondContact CA-O 3.11Å; L219-V221 HydrophobicContact CD2-CG2 4.18Å; L219-V221 HydrophobicContact CG-CG2 4.07Å; L219-V221 PolarHBondContact O-N 3Å; V221-I226 HydrophobicContact CG1-CD1 4.01Å; V221-I226 HydrophobicContact CG1-CG1 4.35Å; V221-I226 VanDerWaalsContact O-CD1 3.28Å; V221-I226 WeakPolarHBondContact O-CD1 3.35Å; V221-I235 HydrophobicContact CG1-CG2 3.82Å; V221-L239 HydrophobicContact CB-CD2 4.38Å; V221-L239 HydrophobicContact CG1-CD2 4.09Å; V221-L239 HydrophobicContact CG2-CD2 4.48Å; V221-W247 HydrophobicContact CG1-CZ3 3.99Å; V221-W247 HydrophobicContact CG2-CE3 4.2Å; V221-W247 HydrophobicContact CG2-CZ3 4.05Å; V221-L277 HydrophobicContact CB-CD2 4.43Å; V221-L277 HydrophobicContact CG1-CD1 3.82Å; V221-L277 HydrophobicContact CG1-CD2 4.12Å
222	P	95.5	Very high	95.2	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.039	23%	0.227	C	C	.	.			trans	-52.7	143.8	-163.9	16.6	-31.5	0	0	0	114.2	R205 M207 E224 A225	R205-P222 WeakPolarHBondContact O-CA 3.48Å; M207-P222 HydrophobicContact CB-CB 4.4Å; M207-P222 HydrophobicContact CE-CB 4.03Å; M207-P222 HydrophobicContact CE-CG 3.66Å; P222-E224 WeakPolarHBondContact CB-OE2 3.4Å; P222-E224 PolarHBondContact O-N 2.97Å; P222-E224 VanDerWaalsContact O-N 3.12Å; P222-A225 HydrophobicContact CG-CB 3.85Å; P222-A225 WeakPolarHBondContact O-CA 3.5Å; P222-A225 PolarHBondContact O-N 3.1Å
223	E	95.3	Very high	95.1	Very high	60 Å²	60	38 Å²	38	28%	0.28	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-55.7	-31.6	175.4	77.7	171.7	-159.9	0	0	111.7	R205 R206 A225 I226 T273	R205-E223 PolarHBondContact O-N 2.75Å; R206-E223 HydrophobicContact CG-CG 3.74Å; R206-E223 WeakPolarHBondContact CG-OE1 3.43Å; R206-E223 IonicContact CZ-OE1 3.66Å; R206-E223 IonicContact NE-OE1 3.23Å; R206-E223 PolarHBondContact NE-OE1 3.28Å; R206-E223 IonicContact NH2-OE1 2.58Å; R206-E223 PolarHBondContact NH2-OE1 3.35Å; R206-E223 IonicContact NH2-OE2 2.67Å; R206-E223 PolarHBondContact NH2-OE2 3.04Å; E223-A225 PolarHBondContact O-N 2.9Å; E223-I226 PolarHBondContact O-N 2.71Å; E223-I226 VanDerWaalsContact O-N 3.11Å; E223-I226 VanDerWaalsContact O-O 3.06Å; E223-T273 HydrophobicContact CB-CG2 3.81Å
224	E	94.4	Very high	94.9	Very high	111 Å²	111	42.8 Å²	42.8	52%	0.519	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-65.2	-21.8	176.8	-55.7	92.3	154.4	0	0	113.2	R206 M207 P222	R206-E224 WeakPolarHBondContact CB-OE1 3.03Å; M207-E224 PolarHBondContact N-OE1 3.14Å; M207-E224 PolarHBondContact N-OE2 3.12Å; P222-E224 WeakPolarHBondContact CB-OE2 3.4Å; P222-E224 PolarHBondContact O-N 2.97Å; P222-E224 VanDerWaalsContact O-N 3.12Å
225	A	94.1	Very high	94.8	Very high	3 Å²	3	42.2 Å²	42.2	3%	0.025	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-101	16	175.6	0	0	0	0	0	113.1	P222 E223 W234 H238	P222-A225 HydrophobicContact CG-CB 3.85Å; P222-A225 WeakPolarHBondContact O-CA 3.5Å; P222-A225 PolarHBondContact O-N 3.1Å; E223-A225 PolarHBondContact O-N 2.9Å; A225-W234 VanDerWaalsContact O-CZ3 3.3Å; A225-W234 WeakPolarHBondContact O-CZ3 3.26Å; A225-H238 HydrophobicContact CB-CB 3.74Å
226	I	96	Very high	94.7	Very high	16 Å²	16	44.6 Å²	44.6	8%	0.082	25%	0.248	C	C	.	.			trans	-130.7	130.3	178.7	-60.8	162.8	0	0	0	109.4	A204 V221 E223 T273 L277	A204-I226 HydrophobicContact CB-CD1 4.18Å; V221-I226 HydrophobicContact CG1-CD1 4.01Å; V221-I226 HydrophobicContact CG1-CG1 4.35Å; V221-I226 VanDerWaalsContact O-CD1 3.28Å; V221-I226 WeakPolarHBondContact O-CD1 3.35Å; E223-I226 PolarHBondContact O-N 2.71Å; E223-I226 VanDerWaalsContact O-N 3.11Å; E223-I226 VanDerWaalsContact O-O 3.06Å; I226-T273 HydrophobicContact CB-CG2 3.99Å; I226-T273 HydrophobicContact CD1-CG2 3.56Å; I226-T273 HydrophobicContact CG1-CG2 4.39Å; I226-T273 HydrophobicContact CG2-CG2 4Å; I226-L277 HydrophobicContact CD1-CB 4.08Å; I226-L277 HydrophobicContact CD1-CD1 4.44Å; I226-L277 HydrophobicContact CD1-CD2 4.08Å; I226-L277 HydrophobicContact CD1-CG 4.43Å; I226-L277 HydrophobicContact CG2-CB 4.48Å
227	S	93.4	Very high	94.7	Very high	48 Å²	48	44.8 Å²	44.8	34%	0.336	26%	0.259	S	S	.	.			trans	-142.7	161.4	169.1	59.6	0	0	0	0	111.9	G229 V230	S227-G229 PolarHBondContact O-N 2.91Å; S227-G229 VanDerWaalsContact O-N 3.14Å; S227-V230 VanDerWaalsContact O-CG1 3.32Å; S227-V230 WeakPolarHBondContact O-CG1 3.45Å; S227-V230 WeakPolarHBondContact O-CG2 3.18Å; S227-V230 PolarHBondContact O-N 2.98Å; S227-V230 WeakPolarHBondContact OG-CG1 3.45Å
228	P	94.4	Very high	94.7	Very high	91 Å²	91	40.4 Å²	40.4	59%	0.591	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	117.8	-172.1	-25.5	36.9	0	0	0	112.7
229	G	89.9	Confident	94.6	Very high	58 Å²	58	39.9 Å²	39.9	60%	0.598	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.7	8.1	179.5	0	0	0	0	0	115.9	S227	S227-G229 PolarHBondContact O-N 2.91Å; S227-G229 VanDerWaalsContact O-N 3.14Å
230	V	93.3	Very high	94.3	Very high	13 Å²	13	41.7 Å²	41.7	8%	0.079	25%	0.246	C	C	.	.			trans	-65.5	162.9	172.3	-61.7	0	0	0	0	112.6	S227 W234 I235 A280	S227-V230 VanDerWaalsContact O-CG1 3.32Å; S227-V230 WeakPolarHBondContact O-CG1 3.45Å; S227-V230 WeakPolarHBondContact O-CG2 3.18Å; S227-V230 PolarHBondContact O-N 2.98Å; S227-V230 WeakPolarHBondContact OG-CG1 3.45Å; V230-W234 HydrophobicContact CB-CB 4.43Å; V230-W234 HydrophobicContact CB-CD2 4.29Å; V230-W234 HydrophobicContact CB-CE3 3.81Å; V230-W234 HydrophobicContact CB-CZ3 4.49Å; V230-W234 HydrophobicContact CG1-CD2 3.83Å; V230-W234 HydrophobicContact CG1-CE3 3.38Å; V230-W234 HydrophobicContact CG1-CG 4.45Å; V230-W234 HydrophobicContact CG1-CH2 4.42Å; V230-W234 HydrophobicContact CG1-CZ3 3.7Å; V230-W234 HydrophobicContact CG2-CE3 4.36Å; V230-I235 HydrophobicContact CG2-CD1 3.89Å; V230-I235 HydrophobicContact CG2-CG1 3.82Å; V230-A280 HydrophobicContact CG2-CB 4.07Å; V230-A280 VanDerWaalsContact O-CB 3.27Å; V230-A280 WeakPolarHBondContact O-CB 3.4Å
231	T	94.3	Very high	94	Very high	60 Å²	60	47.2 Å²	47.2	37%	0.368	28%	0.276	S	S	.	.			trans	-108.4	157.7	171.9	65.5	0	0	0	0	110.5	S233 W234 I235 W284	T231-S233 PolarHBondContact O-N 3.49Å; T231-S233 VanDerWaalsContact O-N 3.14Å; T231-W234 WeakPolarHBondContact O-CB 3.47Å; T231-W234 PolarHBondContact O-N 2.85Å; T231-I235 PolarHBondContact O-N 3.22Å; T231-I235 VanDerWaalsContact O-N 3.15Å; T231-W284 HydrophobicContact CG2-CB 4.33Å
232	A	94.4	Very high	93.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-57.1	-28.5	176.7	0	0	0	0	0	114.2	E236 W247 A280 E285	A232-E236 WeakPolarHBondContact O-CB 3.35Å; A232-E236 PolarHBondContact O-N 3.27Å; A232-W247 HydrophobicContact CB-CZ2 3.83Å; A232-W247 WeakPolarHBondContact O-CZ2 3.34Å; A232-A280 WeakPolarHBondContact CB-O 3.23Å; A232-A280 PolarHBondContact N-O 3.3Å; A232-E285 WeakPolarHBondContact CB-OE2 3.46Å
233	S	93.1	Very high	93.5	Very high	43 Å²	43	54.7 Å²	54.7	30%	0.301	32%	0.316	S	S	.	.	H	α-helix	trans	-72.1	-25.9	173	-68.1	0	0	0	0	113.5	T231 K287	T231-S233 PolarHBondContact O-N 3.49Å; T231-S233 VanDerWaalsContact O-N 3.14Å; S233-K287 PolarHBondContact OG-NZ 2.99Å
234	W	94.1	Very high	93.4	Very high	100 Å²	100	54.1 Å²	54.1	38%	0.379	31%	0.312	S	S	.	.	H	α-helix	trans	-76	-41.6	172.9	-172.4	89.4	0	0	0	111.1	A225 V230 T231 A237 H238	A225-W234 VanDerWaalsContact O-CZ3 3.3Å; A225-W234 WeakPolarHBondContact O-CZ3 3.26Å; V230-W234 HydrophobicContact CB-CB 4.43Å; V230-W234 HydrophobicContact CB-CD2 4.29Å; V230-W234 HydrophobicContact CB-CE3 3.81Å; V230-W234 HydrophobicContact CB-CZ3 4.49Å; V230-W234 HydrophobicContact CG1-CD2 3.83Å; V230-W234 HydrophobicContact CG1-CE3 3.38Å; V230-W234 HydrophobicContact CG1-CG 4.45Å; V230-W234 HydrophobicContact CG1-CH2 4.42Å; V230-W234 HydrophobicContact CG1-CZ3 3.7Å; V230-W234 HydrophobicContact CG2-CE3 4.36Å; T231-W234 WeakPolarHBondContact O-CB 3.47Å; T231-W234 PolarHBondContact O-N 2.85Å; W234-A237 PolarHBondContact O-N 2.98Å; W234-H238 AromaticContact CD2-CE1 3.89Å; W234-H238 AromaticContact CD2-ND1 3.77Å; W234-H238 AromaticContact CE2-CE1 3.39Å; W234-H238 AromaticContact CE2-ND1 3.71Å; W234-H238 AromaticContact CZ2-CE1 3.6Å; W234-H238 AromaticContact CZ2-ND1 3.92Å; W234-H238 AromaticContact NE1-CE1 3.53Å; W234-H238 PolarHBondContact O-ND1 3.18Å
235	I	95.7	Very high	93.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-48	174.1	-58.5	173.7	0	0	0	109.7	V221 V230 T231 A237 H238 L239 W247 L277 A280	V221-I235 HydrophobicContact CG1-CG2 3.82Å; V230-I235 HydrophobicContact CG2-CD1 3.89Å; V230-I235 HydrophobicContact CG2-CG1 3.82Å; T231-I235 PolarHBondContact O-N 3.22Å; T231-I235 VanDerWaalsContact O-N 3.15Å; I235-A237 PolarHBondContact O-N 2.98Å; I235-A237 VanDerWaalsContact O-N 3.08Å; I235-H238 PolarHBondContact O-N 2.98Å; I235-L239 HydrophobicContact CG2-CD2 3.97Å; I235-L239 HydrophobicContact CG2-CG 4.2Å; I235-L239 WeakPolarHBondContact O-CG 3.19Å; I235-L239 PolarHBondContact O-N 3.23Å; I235-L239 VanDerWaalsContact O-N 3.12Å; I235-W247 HydrophobicContact CB-CH2 4.04Å; I235-W247 HydrophobicContact CB-CZ2 3.81Å; I235-W247 HydrophobicContact CD1-CH2 4.01Å; I235-W247 HydrophobicContact CD1-CZ2 4.4Å; I235-W247 HydrophobicContact CG2-CH2 3.66Å; I235-W247 HydrophobicContact CG2-CZ2 3.79Å; I235-W247 HydrophobicContact CG2-CZ3 4.2Å; I235-L277 HydrophobicContact CD1-CD1 3.77Å; I235-A280 HydrophobicContact CD1-CB 3.7Å
236	E	95.3	Very high	93.5	Very high	49 Å²	49	55.6 Å²	55.6	23%	0.229	33%	0.326	C	S	.	.	H	α-helix	trans	-53.1	-33.8	-179.8	-166	161.1	149.4	0	0	114	A232 H238 K244 W247 K248 R250	A232-E236 WeakPolarHBondContact O-CB 3.35Å; A232-E236 PolarHBondContact O-N 3.27Å; E236-H238 VanDerWaalsContact C-N 3.34Å; E236-K244 WeakPolarHBondContact O-CE 3.26Å; E236-W247 PolarHBondContact OE2-NE1 3.27Å; E236-K248 VanDerWaalsContact OE1-CE 3.28Å; E236-K248 WeakPolarHBondContact OE1-CE 3.07Å; E236-K248 WeakPolarHBondContact OE1-CG 3.42Å; E236-R250 IonicContact OE2-CZ 3.23Å; E236-R250 IonicContact OE2-NH1 2.71Å; E236-R250 PolarHBondContact OE2-NH1 2.83Å; E236-R250 IonicContact OE2-NH2 2.61Å
237	A	94.4	Very high	93.5	Very high	69 Å²	69	54.9 Å²	54.9	57%	0.57	32%	0.322	S	S	*	.	H	α-helix	trans	-72.4	-25.4	178.1	0	0	0	0	0	113.6	W234 I235	W234-A237 PolarHBondContact O-N 2.98Å; I235-A237 PolarHBondContact O-N 2.98Å; I235-A237 VanDerWaalsContact O-N 3.08Å
238	H	94	Very high	93.5	Very high	98 Å²	98	57.1 Å²	57.1	45%	0.454	33%	0.326	S	S	.	.	H	α-helix	trans	-106.9	-0.2	-175.4	-60.7	91.4	0	0	0	113.7	A225 W234 I235 E236	A225-H238 HydrophobicContact CB-CB 3.74Å; W234-H238 AromaticContact CD2-CE1 3.89Å; W234-H238 AromaticContact CD2-ND1 3.77Å; W234-H238 AromaticContact CE2-CE1 3.39Å; W234-H238 AromaticContact CE2-ND1 3.71Å; W234-H238 AromaticContact CZ2-CE1 3.6Å; W234-H238 AromaticContact CZ2-ND1 3.92Å; W234-H238 AromaticContact NE1-CE1 3.53Å; W234-H238 PolarHBondContact O-ND1 3.18Å; I235-H238 PolarHBondContact O-N 2.98Å; E236-H238 VanDerWaalsContact C-N 3.34Å
239	L	93.8	Very high	93.5	Very high	6 Å²	6	58 Å²	58	3%	0.031	32%	0.32	C	S	.	.	S	Bend	trans	-68.8	153.5	171.3	-69.1	-174.3	0	0	0	112.4	V221 I235 K244 W247	V221-L239 HydrophobicContact CB-CD2 4.38Å; V221-L239 HydrophobicContact CG1-CD2 4.09Å; V221-L239 HydrophobicContact CG2-CD2 4.48Å; I235-L239 HydrophobicContact CG2-CD2 3.97Å; I235-L239 HydrophobicContact CG2-CG 4.2Å; I235-L239 WeakPolarHBondContact O-CG 3.19Å; I235-L239 PolarHBondContact O-N 3.23Å; I235-L239 VanDerWaalsContact O-N 3.12Å; L239-K244 HydrophobicContact CB-CG 4.07Å; L239-K244 WeakPolarHBondContact O-CE 3.33Å; L239-K244 PolarHBondContact O-NZ 2.89Å; L239-K244 VanDerWaalsContact O-NZ 3.09Å; L239-W247 HydrophobicContact CD1-CB 3.56Å; L239-W247 HydrophobicContact CD1-CD2 3.58Å; L239-W247 HydrophobicContact CD1-CE3 3.92Å; L239-W247 HydrophobicContact CD1-CG 3.42Å; L239-W247 VanDerWaalsContact CD1-CG 3.42Å
240	P	90.4	Very high	93.7	Very high	41 Å²	41	55.4 Å²	55.4	27%	0.266	29%	0.292	S	S	.	.			trans	-66.4	151.8	163.7	31.8	-36.3	0	0	0	110.5	M207 D242 S243 K244	M207-P240 HydrophobicContact CE-CB 4.43Å; M207-P240 HydrophobicContact CE-CG 3.95Å; P240-D242 PolarHBondContact O-N 2.9Å; P240-S243 WeakPolarHBondContact O-CB 3.46Å; P240-S243 PolarHBondContact O-N 2.72Å; P240-K244 PolarHBondContact O-N 3.43Å
241	D	91.3	Very high	93.7	Very high	119 Å²	119	55.8 Å²	55.8	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-62.1	-41.4	-169.8	-70.1	-44.3	0	0	0	113.6	S243 K244	D241-S243 PolarHBondContact O-N 3.37Å; D241-K244 WeakPolarHBondContact O-CB 3.29Å; D241-K244 PolarHBondContact O-N 3.38Å; D241-K244 WeakPolarHBondContact OD1-CD 3.49Å; D241-K244 IonicContact OD1-NZ 2.66Å; D241-K244 PolarHBondContact OD1-NZ 2.88Å
242	D	89.4	Confident	93.7	Very high	154 Å²	154	58.3 Å²	58.3	82%	0.824	31%	0.31	S	S	*	.	H	α-helix	trans	-54.2	-28.3	174.8	-58.2	-19.8	0	0	0	113.1	P240	P240-D242 PolarHBondContact O-N 2.9Å
243	S	93	Very high	93.8	Very high	9 Å²	9	59.2 Å²	59.2	6%	0.063	32%	0.316	C	S	.	.	H	α-helix	trans	-86.5	-22.6	179.9	-65.6	0	0	0	0	113.2	L219 S220 P240 D241 D245 T246 W247	L219-S243 WeakPolarHBondContact CD1-O 3.37Å; S220-S243 PolarHBondContact O-OG 2.87Å; P240-S243 WeakPolarHBondContact O-CB 3.46Å; P240-S243 PolarHBondContact O-N 2.72Å; D241-S243 PolarHBondContact O-N 3.37Å; S243-D245 VanDerWaalsContact C-N 3.32Å; S243-D245 PolarHBondContact O-N 3.48Å; S243-T246 PolarHBondContact O-N 3.44Å; S243-W247 VanDerWaalsContact O-CB 3.23Å; S243-W247 WeakPolarHBondContact O-CB 3.03Å; S243-W247 PolarHBondContact O-N 3.02Å
244	K	93.7	Very high	93.9	Very high	47 Å²	47	60.1 Å²	60.1	20%	0.204	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-35.2	-174.7	-71.2	174.7	-173.9	151.5	0	113	E236 L239 P240 D241 K248	E236-K244 WeakPolarHBondContact O-CE 3.26Å; L239-K244 HydrophobicContact CB-CG 4.07Å; L239-K244 WeakPolarHBondContact O-CE 3.33Å; L239-K244 PolarHBondContact O-NZ 2.89Å; L239-K244 VanDerWaalsContact O-NZ 3.09Å; P240-K244 PolarHBondContact O-N 3.43Å; D241-K244 WeakPolarHBondContact O-CB 3.29Å; D241-K244 PolarHBondContact O-N 3.38Å; D241-K244 WeakPolarHBondContact OD1-CD 3.49Å; D241-K244 IonicContact OD1-NZ 2.66Å; D241-K244 PolarHBondContact OD1-NZ 2.88Å; K244-K248 WeakPolarHBondContact O-CD 3.45Å; K244-K248 VanDerWaalsContact O-CG 3.22Å; K244-K248 WeakPolarHBondContact O-CG 3.37Å; K244-K248 PolarHBondContact O-N 2.88Å
245	D	93.9	Very high	94	Very high	95 Å²	95	58.2 Å²	58.2	51%	0.508	31%	0.308	S	S	.	.	H	α-helix	trans	-76.5	-30.2	-178.5	-81.2	-6.1	0	0	0	113.7	S243 K248 K249	S243-D245 VanDerWaalsContact C-N 3.32Å; S243-D245 PolarHBondContact O-N 3.48Å; D245-K248 IonicContact OD1-NZ 2.68Å; D245-K249 WeakPolarHBondContact O-CD 3.29Å; D245-K249 WeakPolarHBondContact O-CE 3.34Å; D245-K249 VanDerWaalsContact O-CG 3.27Å; D245-K249 WeakPolarHBondContact O-CG 3.22Å; D245-K249 PolarHBondContact O-NZ 3.3Å
246	T	95.3	Very high	94.1	Very high	51 Å²	51	58.4 Å²	58.4	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-77.2	-39.9	171.1	-59.5	0	0	0	0	110.4	I200 L219 S243 K248 K249	I200-T246 HydrophobicContact CD1-CG2 3.92Å; I200-T246 WeakPolarHBondContact CD1-O 3.43Å; I200-T246 HydrophobicContact CG1-CG2 4.03Å; I200-T246 HydrophobicContact CG2-CG2 4.27Å; L219-T246 HydrophobicContact CB-CG2 4.45Å; L219-T246 HydrophobicContact CD1-CG2 4.02Å; L219-T246 HydrophobicContact CD2-CG2 4.12Å; L219-T246 HydrophobicContact CG-CG2 4.45Å; S243-T246 PolarHBondContact O-N 3.44Å; T246-K248 PolarHBondContact O-N 3.38Å; T246-K249 WeakPolarHBondContact O-CB 3.31Å; T246-K249 PolarHBondContact O-N 3.44Å
247	W	95.9	Very high	94.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.6	-42.3	174.8	178.6	-99.7	0	0	0	113.1	M202 L219 V221 A232 I235 E236 L239 S243 K249 R250 L277 L281	M202-W247 HydrophobicContact CE-CE3 3.88Å; M202-W247 HydrophobicContact CE-CZ3 3.94Å; M202-W247 HydrophobicContact SD-CE3 4.12Å; M202-W247 HydrophobicContact SD-CZ3 3.7Å; L219-W247 HydrophobicContact CD2-CB 4.22Å; L219-W247 HydrophobicContact CD2-CE3 4.15Å; V221-W247 HydrophobicContact CG1-CZ3 3.99Å; V221-W247 HydrophobicContact CG2-CE3 4.2Å; V221-W247 HydrophobicContact CG2-CZ3 4.05Å; A232-W247 HydrophobicContact CB-CZ2 3.83Å; A232-W247 WeakPolarHBondContact O-CZ2 3.34Å; I235-W247 HydrophobicContact CB-CH2 4.04Å; I235-W247 HydrophobicContact CB-CZ2 3.81Å; I235-W247 HydrophobicContact CD1-CH2 4.01Å; I235-W247 HydrophobicContact CD1-CZ2 4.4Å; I235-W247 HydrophobicContact CG2-CH2 3.66Å; I235-W247 HydrophobicContact CG2-CZ2 3.79Å; I235-W247 HydrophobicContact CG2-CZ3 4.2Å; E236-W247 PolarHBondContact OE2-NE1 3.27Å; L239-W247 HydrophobicContact CD1-CB 3.56Å; L239-W247 HydrophobicContact CD1-CD2 3.58Å; L239-W247 HydrophobicContact CD1-CE3 3.92Å; L239-W247 HydrophobicContact CD1-CG 3.42Å; L239-W247 VanDerWaalsContact CD1-CG 3.42Å; S243-W247 VanDerWaalsContact O-CB 3.23Å; S243-W247 WeakPolarHBondContact O-CB 3.03Å; S243-W247 PolarHBondContact O-N 3.02Å; W247-K249 VanDerWaalsContact C-N 3.25Å; W247-K249 PolarHBondContact O-N 2.83Å; W247-R250 VanDerWaalsContact O-CB 3.27Å; W247-R250 WeakPolarHBondContact O-CB 3.45Å; W247-R250 VanDerWaalsContact O-CD 3.28Å; W247-R250 WeakPolarHBondContact O-CD 3.48Å; W247-R250 WeakPolarHBondContact O-CG 3.5Å; W247-R250 PolarHBondContact O-N 3.05Å; W247-R250 PolarHBondContact O-NH1 2.78Å; W247-L277 HydrophobicContact CH2-CD1 4.01Å; W247-L277 HydrophobicContact CZ3-CD1 4.19Å; W247-L281 HydrophobicContact CH2-CD2 3.59Å; W247-L281 HydrophobicContact CH2-CG 4.25Å; W247-L281 HydrophobicContact CZ2-CD2 4.19Å; W247-L281 HydrophobicContact CZ3-CD2 3.96Å
248	K	94.6	Very high	94.5	Very high	96 Å²	96	52.8 Å²	52.8	42%	0.417	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-29.4	175.2	-72.3	162.3	-165.6	163.4	0	113.1	E236 K244 D245 T246 R250	E236-K248 VanDerWaalsContact OE1-CE 3.28Å; E236-K248 WeakPolarHBondContact OE1-CE 3.07Å; E236-K248 WeakPolarHBondContact OE1-CG 3.42Å; K244-K248 WeakPolarHBondContact O-CD 3.45Å; K244-K248 VanDerWaalsContact O-CG 3.22Å; K244-K248 WeakPolarHBondContact O-CG 3.37Å; K244-K248 PolarHBondContact O-N 2.88Å; D245-K248 IonicContact OD1-NZ 2.68Å; T246-K248 PolarHBondContact O-N 3.38Å; K248-R250 PolarHBondContact O-N 3.2Å
249	K	94.4	Very high	94.6	Very high	109 Å²	109	48.1 Å²	48.1	47%	0.474	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-79.3	0.8	178.8	-64.4	161.7	-164.9	155.7	0	113.4	D245 T246 W247 G251 N252 V253	D245-K249 WeakPolarHBondContact O-CD 3.29Å; D245-K249 WeakPolarHBondContact O-CE 3.34Å; D245-K249 VanDerWaalsContact O-CG 3.27Å; D245-K249 WeakPolarHBondContact O-CG 3.22Å; D245-K249 PolarHBondContact O-NZ 3.3Å; T246-K249 WeakPolarHBondContact O-CB 3.31Å; T246-K249 PolarHBondContact O-N 3.44Å; W247-K249 VanDerWaalsContact C-N 3.25Å; W247-K249 PolarHBondContact O-N 2.83Å; K249-G251 VanDerWaalsContact C-N 3.26Å; K249-G251 PolarHBondContact O-N 3.4Å; K249-N252 WeakPolarHBondContact O-CB 3.15Å; K249-N252 PolarHBondContact O-N 2.65Å; K249-V253 PolarHBondContact O-N 2.76Å
250	R	94.5	Very high	94.7	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.011	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-54	-35.4	-179.4	69.9	-170.5	175	-88.7	8.3	114.4	M202 E236 W247 K248 N252 V253 E285 T288 L290	M202-R250 HydrophobicContact CE-CB 4.2Å; E236-R250 IonicContact OE2-CZ 3.23Å; E236-R250 IonicContact OE2-NH1 2.71Å; E236-R250 PolarHBondContact OE2-NH1 2.83Å; E236-R250 IonicContact OE2-NH2 2.61Å; W247-R250 VanDerWaalsContact O-CB 3.27Å; W247-R250 WeakPolarHBondContact O-CB 3.45Å; W247-R250 VanDerWaalsContact O-CD 3.28Å; W247-R250 WeakPolarHBondContact O-CD 3.48Å; W247-R250 WeakPolarHBondContact O-CG 3.5Å; W247-R250 PolarHBondContact O-N 3.05Å; W247-R250 PolarHBondContact O-NH1 2.78Å; K248-R250 PolarHBondContact O-N 3.2Å; R250-N252 VanDerWaalsContact C-N 3.33Å; R250-V253 WeakPolarHBondContact O-CG2 3.23Å; R250-E285 IonicContact CZ-OE2 3.57Å; R250-E285 IonicContact NE-OE2 3.59Å; R250-E285 PolarHBondContact NE-OE2 2.85Å; R250-E285 IonicContact NH2-OE2 3.89Å; R250-E285 PolarHBondContact NH2-OE2 2.97Å; R250-T288 HydrophobicContact CG-CG2 3.67Å; R250-L290 HydrophobicContact CB-CD2 3.91Å; R250-L290 HydrophobicContact CG-CD2 3.95Å; R250-L290 WeakPolarHBondContact O-CD2 3.32Å
251	G	93.1	Very high	95	Very high	22 Å²	22	48.1 Å²	48.1	23%	0.227	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-80	-9.8	176.7	0	0	0	0	0	114.7	K249	K249-G251 VanDerWaalsContact C-N 3.26Å; K249-G251 PolarHBondContact O-N 3.4Å
252	N	94.5	Very high	95.2	Very high	113 Å²	113	45.1 Å²	45.1	60%	0.604	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-26.3	179.5	-61	90.2	0	0	0	112.5	K249 R250 R291	K249-N252 WeakPolarHBondContact O-CB 3.15Å; K249-N252 PolarHBondContact O-N 2.65Å; R250-N252 VanDerWaalsContact C-N 3.33Å; N252-R291 PolarHBondContact O-NH2 2.83Å
253	V	95.5	Very high	95.4	Very high	19 Å²	19	39.1 Å²	39.1	12%	0.115	20%	0.198	C	C	.	.	S	Bend	trans	-83.7	161.8	178.7	-59.3	0	0	0	0	112.3	S198 I200 K249 R250 V256	S198-V253 WeakPolarHBondContact OG-CA 3.45Å; I200-V253 HydrophobicContact CB-CG2 4.37Å; I200-V253 HydrophobicContact CD1-CG1 3.91Å; I200-V253 HydrophobicContact CD1-CG2 3.86Å; I200-V253 HydrophobicContact CG1-CG1 4.01Å; I200-V253 HydrophobicContact CG1-CG2 4.08Å; K249-V253 PolarHBondContact O-N 2.76Å; R250-V253 WeakPolarHBondContact O-CG2 3.23Å; V253-V256 HydrophobicContact CG2-CG2 4.16Å
254	E	95.5	Very high	95.5	Very high	62 Å²	62	39.6 Å²	39.6	29%	0.29	20%	0.201	S	C	.	.	S	Bend	trans	-86.7	-37.1	-178.8	-164.1	171.1	139	0	0	112.2	S198 R291 N292	S198-E254 PolarHBondContact O-N 3.22Å; S198-E254 WeakPolarHBondContact OG-CB 3.36Å; S198-E254 PolarHBondContact OG-N 3.44Å; E254-R291 IonicContact OE2-NH1 3.23Å; E254-N292 PolarHBondContact O-ND2 3.1Å
255	Y	96.5	Very high	95.4	Very high	60 Å²	60	38.5 Å²	38.5	24%	0.235	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.6	-179.1	-59.8	-80.6	0	0	0	112.4	M191 I197 S198 L199 I200 N292 L295	M191-Y255 HydrophobicContact CE-CD1 4.01Å; M191-Y255 HydrophobicContact CE-CD2 3.36Å; M191-Y255 HydrophobicContact CE-CE2 3.99Å; M191-Y255 HydrophobicContact CE-CG 3.37Å; I197-Y255 HydrophobicContact CG2-CD2 3.75Å; I197-Y255 HydrophobicContact CG2-CE2 4.07Å; S198-Y255 PolarHBondContact O-N 3.35Å; L199-Y255 WeakPolarHBondContact CA-O 3.37Å; I200-Y255 PolarHBondContact N-O 2.89Å; Y255-N292 HydrophobicContact CD1-CB 4.12Å; Y255-N292 HydrophobicContact CE1-CB 4.22Å; Y255-N292 WeakPolarHBondContact CE1-ND2 3.44Å; Y255-L295 HydrophobicContact CD1-CD1 4.41Å
256	V	97.8	Very high	95.3	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.03	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.7	167.3	177.4	0	0	0	0	107.4	I200 M202 V253 L258 L281 L290 P294 L295	I200-V256 WeakPolarHBondContact O-CA 3.31Å; M202-V256 HydrophobicContact CE-CG1 3.75Å; M202-V256 HydrophobicContact CE-CG2 4.48Å; M202-V256 HydrophobicContact CG-CG1 4.06Å; M202-V256 HydrophobicContact SD-CG1 3.77Å; V253-V256 HydrophobicContact CG2-CG2 4.16Å; V256-L258 HydrophobicContact CG1-CD2 3.78Å; V256-L281 HydrophobicContact CG1-CD1 4.41Å; V256-L290 HydrophobicContact CB-CD1 4.36Å; V256-L290 HydrophobicContact CG2-CD1 4.03Å; V256-L290 HydrophobicContact CG2-CD2 4.1Å; V256-P294 WeakPolarHBondContact O-CA 3.46Å; V256-L295 PolarHBondContact O-N 2.82Å
257	V	98.1	Very high	95.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.4	176.9	174.8	0	0	0	0	108.6	I183 L188 L199 I200 I201 M202 L295 L297	I183-V257 HydrophobicContact CD1-CG2 4.09Å; I183-V257 HydrophobicContact CG2-CG1 3.68Å; I183-V257 HydrophobicContact CG2-CG2 4.07Å; L188-V257 HydrophobicContact CD1-CB 4.38Å; L188-V257 HydrophobicContact CD1-CG1 4.25Å; L188-V257 HydrophobicContact CD1-CG2 4.19Å; L188-V257 HydrophobicContact CD2-CG1 4.3Å; L199-V257 HydrophobicContact CD1-CB 4.18Å; L199-V257 HydrophobicContact CD1-CG2 3.58Å; I200-V257 PolarHBondContact O-N 3.25Å; I201-V257 CarbonylContact C-O 3.56Å; I201-V257 WeakPolarHBondContact CA-O 3.48Å; M202-V257 PolarHBondContact N-O 3.13Å; V257-L295 CarbonylContact C-O 3.53Å; V257-L295 WeakPolarHBondContact CA-O 3.34Å; V257-L295 HydrophobicContact CG2-CB 4.32Å; V257-L297 HydrophobicContact CG1-CB 4.24Å
258	L	98.3	Very high	94.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141	-179.4	-46.1	-178.5	0	0	0	109.3	M202 V256 L274 L277 K278 L281 P294 L295 V296 L297	M202-L258 HydrophobicContact CB-CD2 3.82Å; M202-L258 HydrophobicContact CG-CD2 4.19Å; M202-L258 WeakPolarHBondContact O-CA 3.39Å; M202-L258 HydrophobicContact SD-CD2 4Å; V256-L258 HydrophobicContact CG1-CD2 3.78Å; L258-L274 HydrophobicContact CB-CD2 3.85Å; L258-L277 HydrophobicContact CD1-CD2 4.41Å; L258-L277 HydrophobicContact CD1-CG 4.3Å; L258-L277 HydrophobicContact CD2-CD2 3.96Å; L258-L277 HydrophobicContact CD2-CG 4.29Å; L258-K278 HydrophobicContact CD1-CB 3.78Å; L258-K278 HydrophobicContact CD1-CG 4.41Å; L258-L281 HydrophobicContact CD2-CD1 3.86Å; L258-P294 HydrophobicContact CD1-CB 3.82Å; L258-P294 HydrophobicContact CD2-CB 4.35Å; L258-P294 HydrophobicContact CG-CB 3.96Å; L258-L295 PolarHBondContact N-O 2.86Å; L258-V296 WeakPolarHBondContact O-CA 3.21Å; L258-L297 PolarHBondContact O-N 3.09Å
259	L	97.4	Very high	94.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.7	173.8	69.5	90.7	0	0	0	111.8	I201 M202 D203 A204 I215 L297 Y301	I201-L259 HydrophobicContact CG2-CD2 3.66Å; M202-L259 PolarHBondContact O-N 2.89Å; D203-L259 HydrophobicContact CB-CD1 4.18Å; D203-L259 HydrophobicContact CB-CG 4.46Å; A204-L259 WeakPolarHBondContact CB-O 3.3Å; A204-L259 PolarHBondContact N-O 3.4Å; I215-L259 HydrophobicContact CD1-CD2 3.44Å; I215-L259 VanDerWaalsContact CD1-CD2 3.44Å; I215-L259 HydrophobicContact CG1-CD2 4.16Å; L259-L297 HydrophobicContact CB-CB 3.88Å; L259-L297 HydrophobicContact CB-CD2 3.97Å; L259-L297 HydrophobicContact CD2-CD2 3.85Å; L259-Y301 HydrophobicContact CD1-CD2 4.17Å; L259-Y301 HydrophobicContact CD1-CG 4.45Å
260	D	96.3	Very high	94.4	Very high	27 Å²	27	47.6 Å²	47.6	14%	0.144	24%	0.244	C	C	.	.			trans	-121.4	-153.6	160.4	70.3	26.6	0	0	0	109.5	R205 F262 S263 L274 G300 Y301	R205-D260 HydrophobicContact CG-CB 4.3Å; D260-F262 PolarHBondContact OD1-N 3.37Å; D260-S263 WeakPolarHBondContact OD1-CB 3.45Å; D260-S263 PolarHBondContact OD1-N 2.95Å; D260-S263 WeakPolarHBondContact OD2-CB 3.24Å; D260-S263 PolarHBondContact OD2-OG 2.73Å; D260-L274 HydrophobicContact CB-CD1 4.06Å; D260-L274 HydrophobicContact CB-CD2 4.41Å; D260-L274 HydrophobicContact CB-CG 4.14Å; D260-L274 VanDerWaalsContact OD2-CD1 3.29Å; D260-L274 WeakPolarHBondContact OD2-CD1 3.5Å; D260-G300 CarbonylContact O-C 3.59Å; D260-G300 WeakPolarHBondContact O-CA 3.42Å; D260-Y301 WeakPolarHBondContact O-CB 3.31Å; D260-Y301 PolarHBondContact O-N 3.43Å
261	W	96.1	Very high	94	Very high	20 Å²	20	49.6 Å²	49.6	8%	0.076	27%	0.266	C	S	.	.	S	Bend	trans	-68.8	-39.9	176.7	-84.8	110	0	0	0	115	R205 D209 Y301 E302 L305 V317 P319 P320	R205-W261 HydrophobicContact CG-CG 4.15Å; R205-W261 VanDerWaalsContact NH1-CZ2 3.27Å; D209-W261 HydrophobicContact CB-CZ2 3.87Å; D209-W261 VanDerWaalsContact CG-NE1 3.32Å; D209-W261 PolarHBondContact OD2-NE1 3.48Å; W261-Y301 HydrophobicContact CE3-CD1 4.19Å; W261-Y301 HydrophobicContact CH2-CD1 4.19Å; W261-Y301 AromaticContact CZ3-CD1 3.75Å; W261-Y301 HydrophobicContact CZ3-CD1 3.75Å; W261-Y301 PolarHBondContact O-N 2.81Å; W261-E302 WeakPolarHBondContact O-CB 3.05Å; W261-E302 PolarHBondContact O-N 3.21Å; W261-L305 HydrophobicContact CZ3-CD1 4.35Å; W261-V317 HydrophobicContact CH2-CG1 4.2Å; W261-V317 HydrophobicContact CH2-CG2 3.99Å; W261-P319 HydrophobicContact CE3-CB 4.04Å; W261-P319 HydrophobicContact CZ3-CB 3.95Å; W261-P319 HydrophobicContact CZ3-CG 4.17Å; W261-P320 HydrophobicContact CD2-CG 3.94Å; W261-P320 HydrophobicContact CG-CG 3.87Å
262	F	95.1	Very high	94	Very high	56 Å²	56	50.6 Å²	50.6	25%	0.246	27%	0.268	C	S	.	.	S	Bend	trans	-143.7	-24.3	-159.1	-54.5	-56	0	0	0	115.3	D260 E302 P319 P320 R322	D260-F262 PolarHBondContact OD1-N 3.37Å; F262-E302 HydrophobicContact CD1-CB 3.9Å; F262-E302 HydrophobicContact CD1-CG 4.47Å; F262-E302 VanDerWaalsContact CD1-OE2 3.26Å; F262-E302 WeakPolarHBondContact CD1-OE2 3.4Å; F262-E302 HydrophobicContact CE1-CB 3.97Å; F262-E302 VanDerWaalsContact CE1-CD 3.5Å; F262-E302 HydrophobicContact CE1-CG 4.3Å; F262-E302 WeakPolarHBondContact CE1-OE2 3.24Å; F262-P319 HydrophobicContact CE1-CB 3.89Å; F262-P319 HydrophobicContact CZ-CB 4Å; F262-P320 HydrophobicContact CE2-CG 3.99Å; F262-P320 HydrophobicContact CZ-CG 3.93Å; F262-P320 VanDerWaalsContact CZ-O 3.26Å; F262-P320 WeakPolarHBondContact CZ-O 3.4Å; F262-R322 HydrophobicContact CD1-CG 4.4Å; F262-R322 HydrophobicContact CD2-CG 4.5Å; F262-R322 HydrophobicContact CE1-CG 4.12Å; F262-R322 HydrophobicContact CE2-CG 4.22Å; F262-R322 HydrophobicContact CZ-CG 4.04Å
263	S	94	Very high	94.1	Very high	28 Å²	28	47 Å²	47	20%	0.196	25%	0.25	C	C	.	.			trans	-74.8	143.3	-168	-73.7	0	0	0	0	113.1	D260	D260-S263 WeakPolarHBondContact OD1-CB 3.45Å; D260-S263 PolarHBondContact OD1-N 2.95Å; D260-S263 WeakPolarHBondContact OD2-CB 3.24Å; D260-S263 PolarHBondContact OD2-OG 2.73Å
264	S	94.4	Very high	94.1	Very high	18 Å²	18	46.1 Å²	46.1	13%	0.126	25%	0.245	C	C	.	.			trans	-100.7	172.5	168.9	-86.9	0	0	0	0	111	K266 D267 L268 E298 G299	S264-K266 PolarHBondContact O-N 3.17Å; S264-K266 VanDerWaalsContact O-N 3.07Å; S264-D267 WeakPolarHBondContact CB-OD2 3.37Å; S264-D267 PolarHBondContact N-OD2 3.47Å; S264-D267 PolarHBondContact O-N 2.95Å; S264-L268 WeakPolarHBondContact O-CD1 3.47Å; S264-E298 WeakPolarHBondContact CA-OE1 3.44Å; S264-E298 VanDerWaalsContact CB-CD 3.45Å; S264-E298 WeakPolarHBondContact CB-OE1 3.18Å; S264-E298 WeakPolarHBondContact CB-OE2 3.36Å; S264-E298 PolarHBondContact OG-OE1 3.27Å; S264-E298 PolarHBondContact OG-OE2 3.46Å; S264-G299 PolarHBondContact OG-N 3.01Å; S264-G299 VanDerWaalsContact OG-N 3.11Å
265	A	92.6	Very high	94.2	Very high	25 Å²	25	46.9 Å²	46.9	21%	0.207	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-56.9	-26.7	177.4	0	0	0	0	0	113.2	A182 D267 V296 E298	A182-A265 HydrophobicContact CB-CB 3.63Å; A265-D267 VanDerWaalsContact C-N 3.33Å; A265-V296 HydrophobicContact CB-CB 4.13Å; A265-E298 PolarHBondContact N-OE1 3.49Å
266	K	91.1	Very high	94.2	Very high	133 Å²	133	44.4 Å²	44.4	58%	0.578	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-67.1	-27.5	176.6	-59.1	-179.1	178.6	79.7	0	113.6	E179 S264	E179-K266 WeakPolarHBondContact OE1-CE 3.14Å; E179-K266 IonicContact OE1-NZ 3.35Å; E179-K266 PolarHBondContact OE1-NZ 3.43Å; E179-K266 VanDerWaalsContact OE2-CE 3.29Å; E179-K266 WeakPolarHBondContact OE2-CE 3.19Å; E179-K266 IonicContact OE2-NZ 2.82Å; E179-K266 PolarHBondContact OE2-NZ 3.49Å; S264-K266 PolarHBondContact O-N 3.17Å; S264-K266 VanDerWaalsContact O-N 3.07Å
267	D	90.7	Very high	94.1	Very high	74 Å²	74	44.1 Å²	44.1	40%	0.396	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-90.9	0.7	-171.5	-54.1	-60	0	0	0	113.7	S264 A265 Q269	S264-D267 WeakPolarHBondContact CB-OD2 3.37Å; S264-D267 PolarHBondContact N-OD2 3.47Å; S264-D267 PolarHBondContact O-N 2.95Å; A265-D267 VanDerWaalsContact C-N 3.33Å; D267-Q269 PolarHBondContact O-N 3.36Å
268	L	91.6	Very high	94	Very high	22 Å²	22	44.8 Å²	44.8	12%	0.115	24%	0.237	C	C	.	.			trans	-74.2	69.6	-178.1	-92.4	68.3	0	0	0	112.8	S264 L274 R275 K278 V296	S264-L268 WeakPolarHBondContact O-CD1 3.47Å; L268-L274 HydrophobicContact CD1-CB 3.85Å; L268-L274 HydrophobicContact CD1-CD1 4.11Å; L268-L274 HydrophobicContact CD2-CB 4.26Å; L268-L274 HydrophobicContact CG-CB 3.98Å; L268-R275 HydrophobicContact CB-CB 4.22Å; L268-R275 HydrophobicContact CG-CB 4.25Å; L268-R275 WeakPolarHBondContact O-CD 3.1Å; L268-K278 HydrophobicContact CD2-CB 4.47Å; L268-K278 HydrophobicContact CD2-CD 3.89Å; L268-V296 HydrophobicContact CD1-CG1 4.15Å; L268-V296 HydrophobicContact CD1-CG2 3.86Å; L268-V296 HydrophobicContact CD2-CG2 3.61Å; L268-V296 HydrophobicContact CG-CG2 4.4Å
269	Q	90.4	Very high	93.9	Very high	142 Å²	142	45.8 Å²	45.8	66%	0.664	24%	0.243	S	C	*	.			trans	-77.7	159	172.7	-57.4	-174.1	16.7	0	0	111.9	D267 G271 T272 R275	D267-Q269 PolarHBondContact O-N 3.36Å; Q269-G271 PolarHBondContact O-N 3.3Å; Q269-T272 HydrophobicContact CB-CG2 4.19Å; Q269-T272 PolarHBondContact O-N 3.08Å; Q269-T272 PolarHBondContact O-OG1 2.96Å; Q269-R275 WeakPolarHBondContact O-CB 3.45Å; Q269-R275 WeakPolarHBondContact O-CG 3.38Å
270	I	88.8	Confident	93.8	Very high	170 Å²	170	45.8 Å²	45.8	87%	0.872	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	121.5	176	-59.3	175.6	0	0	0	108.8
271	G	87.1	Confident	93.7	Very high	45 Å²	45	44.6 Å²	44.6	46%	0.464	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.2	-13	-178.5	0	0	0	0	0	114.9	Q269	Q269-G271 PolarHBondContact O-N 3.3Å
272	T	92.9	Very high	93.6	Very high	43 Å²	43	48 Å²	48	26%	0.264	25%	0.252	S	S	.	.			trans	-74.5	154.7	174	72.9	0	0	0	0	111.7	Q269 R275 S276	Q269-T272 HydrophobicContact CB-CG2 4.19Å; Q269-T272 PolarHBondContact O-N 3.08Å; Q269-T272 PolarHBondContact O-OG1 2.96Å; T272-R275 PolarHBondContact O-N 3.45Å; T272-R275 VanDerWaalsContact OG1-CB 3.3Å; T272-R275 WeakPolarHBondContact OG1-CB 3.35Å; T272-R275 PolarHBondContact OG1-N 3.03Å; T272-S276 WeakPolarHBondContact O-CB 3.43Å; T272-S276 PolarHBondContact O-N 3.36Å; T272-S276 PolarHBondContact O-OG 2.61Å
273	T	95.7	Very high	93.5	Very high	38 Å²	38	50.9 Å²	50.9	23%	0.233	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-52.1	179.9	-45.6	0	0	0	0	111.2	A204 E223 I226 R275 S276 L277	A204-T273 HydrophobicContact CB-CG2 4.21Å; E223-T273 HydrophobicContact CB-CG2 3.81Å; I226-T273 HydrophobicContact CB-CG2 3.99Å; I226-T273 HydrophobicContact CD1-CG2 3.56Å; I226-T273 HydrophobicContact CG1-CG2 4.39Å; I226-T273 HydrophobicContact CG2-CG2 4Å; T273-R275 PolarHBondContact O-N 3.25Å; T273-S276 PolarHBondContact O-N 3.38Å; T273-L277 WeakPolarHBondContact O-CB 3.37Å; T273-L277 PolarHBondContact O-N 3.33Å
274	L	96.6	Very high	93.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-39.1	178.3	-69.4	178.4	0	0	0	113.5	A204 L258 D260 L268 K278 V296	A204-L274 HydrophobicContact CB-CD2 3.76Å; L258-L274 HydrophobicContact CB-CD2 3.85Å; D260-L274 HydrophobicContact CB-CD1 4.06Å; D260-L274 HydrophobicContact CB-CD2 4.41Å; D260-L274 HydrophobicContact CB-CG 4.14Å; D260-L274 VanDerWaalsContact OD2-CD1 3.29Å; D260-L274 WeakPolarHBondContact OD2-CD1 3.5Å; L268-L274 HydrophobicContact CD1-CB 3.85Å; L268-L274 HydrophobicContact CD1-CD1 4.11Å; L268-L274 HydrophobicContact CD2-CB 4.26Å; L268-L274 HydrophobicContact CG-CB 3.98Å; L274-K278 WeakPolarHBondContact O-CB 3.26Å; L274-K278 PolarHBondContact O-N 2.96Å; L274-V296 HydrophobicContact CD1-CG1 4.02Å
275	R	96.1	Very high	93	Very high	78 Å²	78	55.9 Å²	55.9	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-44.9	175.4	-177.6	71.3	-139.7	-178.3	8.5	110.9	L268 Q269 T272 T273 K278 D279	L268-R275 HydrophobicContact CB-CB 4.22Å; L268-R275 HydrophobicContact CG-CB 4.25Å; L268-R275 WeakPolarHBondContact O-CD 3.1Å; Q269-R275 WeakPolarHBondContact O-CB 3.45Å; Q269-R275 WeakPolarHBondContact O-CG 3.38Å; T272-R275 PolarHBondContact O-N 3.45Å; T272-R275 VanDerWaalsContact OG1-CB 3.3Å; T272-R275 WeakPolarHBondContact OG1-CB 3.35Å; T272-R275 PolarHBondContact OG1-N 3.03Å; T273-R275 PolarHBondContact O-N 3.25Å; R275-K278 PolarHBondContact O-N 3.19Å; R275-D279 IonicContact CZ-OD1 2.74Å; R275-D279 IonicContact CZ-OD2 2.75Å; R275-D279 IonicContact NE-OD1 3.47Å; R275-D279 IonicContact NE-OD2 3.64Å; R275-D279 PolarHBondContact NE-OD2 3.28Å; R275-D279 IonicContact NH2-OD1 3.81Å; R275-D279 PolarHBondContact NH2-OD1 2.93Å; R275-D279 IonicContact NH2-OD2 2.76Å; R275-D279 PolarHBondContact NH2-OD2 2.87Å; R275-D279 WeakPolarHBondContact O-CB 3.48Å; R275-D279 PolarHBondContact O-N 2.88Å
276	S	96.4	Very high	92.4	Very high	8 Å²	8	59.7 Å²	59.7	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-43.4	-178.7	-55.8	0	0	0	0	111.5	T272 T273 A280	T272-S276 WeakPolarHBondContact O-CB 3.43Å; T272-S276 PolarHBondContact O-N 3.36Å; T272-S276 PolarHBondContact O-OG 2.61Å; T273-S276 PolarHBondContact O-N 3.38Å; S276-A280 VanDerWaalsContact O-CB 3.24Å; S276-A280 WeakPolarHBondContact O-CB 3.39Å; S276-A280 PolarHBondContact O-N 3.39Å
277	L	96.9	Very high	92.2	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-46.7	173.7	178.7	56.6	0	0	0	112.1	A204 V221 I226 I235 W247 L258 T273 D279 A280 L281	A204-L277 HydrophobicContact CB-CD2 4.01Å; V221-L277 HydrophobicContact CB-CD2 4.43Å; V221-L277 HydrophobicContact CG1-CD1 3.82Å; V221-L277 HydrophobicContact CG1-CD2 4.12Å; I226-L277 HydrophobicContact CD1-CB 4.08Å; I226-L277 HydrophobicContact CD1-CD1 4.44Å; I226-L277 HydrophobicContact CD1-CD2 4.08Å; I226-L277 HydrophobicContact CD1-CG 4.43Å; I226-L277 HydrophobicContact CG2-CB 4.48Å; I235-L277 HydrophobicContact CD1-CD1 3.77Å; W247-L277 HydrophobicContact CH2-CD1 4.01Å; W247-L277 HydrophobicContact CZ3-CD1 4.19Å; L258-L277 HydrophobicContact CD1-CD2 4.41Å; L258-L277 HydrophobicContact CD1-CG 4.3Å; L258-L277 HydrophobicContact CD2-CD2 3.96Å; L258-L277 HydrophobicContact CD2-CG 4.29Å; T273-L277 WeakPolarHBondContact O-CB 3.37Å; T273-L277 PolarHBondContact O-N 3.33Å; L277-D279 PolarHBondContact O-N 3.12Å; L277-A280 PolarHBondContact O-N 3.16Å; L277-L281 HydrophobicContact CD1-CD1 3.78Å; L277-L281 HydrophobicContact CD1-CG 4.04Å; L277-L281 HydrophobicContact CG-CD1 3.88Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 WeakPolarHBondContact O-CG 3.18Å; L277-L281 PolarHBondContact O-N 3.27Å
278	K	96.3	Very high	92.1	Very high	13 Å²	13	58.9 Å²	58.9	6%	0.057	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-42.7	179.2	-176.8	161	174.4	165.5	0	112.4	L258 L268 L274 R275 L281 F282 E293 P294	L258-K278 HydrophobicContact CD1-CB 3.78Å; L258-K278 HydrophobicContact CD1-CG 4.41Å; L268-K278 HydrophobicContact CD2-CB 4.47Å; L268-K278 HydrophobicContact CD2-CD 3.89Å; L274-K278 WeakPolarHBondContact O-CB 3.26Å; L274-K278 PolarHBondContact O-N 2.96Å; R275-K278 PolarHBondContact O-N 3.19Å; K278-L281 PolarHBondContact O-N 2.96Å; K278-F282 PolarHBondContact O-N 3.5Å; K278-E293 WeakPolarHBondContact CE-OE1 3.28Å; K278-E293 IonicContact NZ-OE1 3.43Å; K278-E293 PolarHBondContact NZ-OE1 3.42Å; K278-P294 HydrophobicContact CD-CB 4.45Å; K278-P294 WeakPolarHBondContact CE-O 3.49Å; K278-P294 HydrophobicContact CG-CB 4.25Å; K278-P294 HydrophobicContact CG-CG 4.41Å; K278-P294 PolarHBondContact NZ-O 3.37Å
279	D	95.1	Very high	92	Very high	22 Å²	22	63.2 Å²	63.2	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-41.6	173.2	-80	-40.7	0	0	0	111.7	R275 L277 L281 K283 W284	R275-D279 IonicContact CZ-OD1 2.74Å; R275-D279 IonicContact CZ-OD2 2.75Å; R275-D279 IonicContact NE-OD1 3.47Å; R275-D279 IonicContact NE-OD2 3.64Å; R275-D279 PolarHBondContact NE-OD2 3.28Å; R275-D279 IonicContact NH2-OD1 3.81Å; R275-D279 PolarHBondContact NH2-OD1 2.93Å; R275-D279 IonicContact NH2-OD2 2.76Å; R275-D279 PolarHBondContact NH2-OD2 2.87Å; R275-D279 WeakPolarHBondContact O-CB 3.48Å; R275-D279 PolarHBondContact O-N 2.88Å; L277-D279 PolarHBondContact O-N 3.12Å; D279-L281 VanDerWaalsContact C-N 3.27Å; D279-L281 PolarHBondContact O-N 2.7Å; D279-K283 HydrophobicContact CB-CB 4.34Å; D279-K283 HydrophobicContact CB-CD 4.28Å; D279-K283 CarbonylContact O-C 3.5Å; D279-K283 WeakPolarHBondContact O-CA 3.45Å; D279-K283 WeakPolarHBondContact O-CB 3.43Å; D279-K283 PolarHBondContact O-N 3.04Å; D279-K283 WeakPolarHBondContact OD1-CD 3.47Å; D279-W284 PolarHBondContact O-N 2.76Å
280	A	95.6	Very high	92.1	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-32.8	177.1	0	0	0	0	0	113.6	V230 A232 I235 S276 L277	V230-A280 HydrophobicContact CG2-CB 4.07Å; V230-A280 VanDerWaalsContact O-CB 3.27Å; V230-A280 WeakPolarHBondContact O-CB 3.4Å; A232-A280 WeakPolarHBondContact CB-O 3.23Å; A232-A280 PolarHBondContact N-O 3.3Å; I235-A280 HydrophobicContact CD1-CB 3.7Å; S276-A280 VanDerWaalsContact O-CB 3.24Å; S276-A280 WeakPolarHBondContact O-CB 3.39Å; S276-A280 PolarHBondContact O-N 3.39Å; L277-A280 PolarHBondContact O-N 3.16Å
281	L	95.2	Very high	92.2	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-83.9	-36	-179.7	-77.2	170.1	0	0	0	114.5	M202 W247 V256 L258 L277 K278 D279 E285 L290 P294	M202-L281 HydrophobicContact CE-CD2 4.38Å; M202-L281 HydrophobicContact SD-CD1 3.8Å; M202-L281 HydrophobicContact SD-CD2 4.47Å; W247-L281 HydrophobicContact CH2-CD2 3.59Å; W247-L281 HydrophobicContact CH2-CG 4.25Å; W247-L281 HydrophobicContact CZ2-CD2 4.19Å; W247-L281 HydrophobicContact CZ3-CD2 3.96Å; V256-L281 HydrophobicContact CG1-CD1 4.41Å; L258-L281 HydrophobicContact CD2-CD1 3.86Å; L277-L281 HydrophobicContact CD1-CD1 3.78Å; L277-L281 HydrophobicContact CD1-CG 4.04Å; L277-L281 HydrophobicContact CG-CD1 3.88Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 WeakPolarHBondContact O-CG 3.18Å; L277-L281 PolarHBondContact O-N 3.27Å; K278-L281 PolarHBondContact O-N 2.96Å; D279-L281 VanDerWaalsContact C-N 3.27Å; D279-L281 PolarHBondContact O-N 2.7Å; L281-E285 VanDerWaalsContact O-CB 3.3Å; L281-E285 WeakPolarHBondContact O-CB 3.28Å; L281-L290 HydrophobicContact CB-CD1 4.16Å; L281-P294 HydrophobicContact CB-CG 4.23Å; L281-P294 HydrophobicContact CD1-CG 4.41Å
282	F	94	Very high	92.5	Very high	92 Å²	92	56.4 Å²	56.4	40%	0.404	27%	0.274	S	S	.	.	H	α-helix	trans	-123.1	-15.9	-167.1	-161.7	-109.4	0	0	0	114.9	K278 L290 N292 E293 P294	K278-F282 PolarHBondContact O-N 3.5Å; F282-L290 HydrophobicContact CD2-CB 4.23Å; F282-L290 HydrophobicContact CD2-CD1 4.45Å; F282-L290 HydrophobicContact CE2-CB 4.48Å; F282-N292 WeakPolarHBondContact CE2-O 3.06Å; F282-E293 HydrophobicContact CD1-CB 4.26Å; F282-E293 HydrophobicContact CD1-CG 3.92Å; F282-E293 HydrophobicContact CE1-CB 3.83Å; F282-E293 HydrophobicContact CE1-CG 3.9Å; F282-E293 HydrophobicContact CE2-CB 4.41Å; F282-E293 HydrophobicContact CG-CG 4.5Å; F282-E293 HydrophobicContact CZ-CB 3.91Å; F282-E293 HydrophobicContact CZ-CG 4.47Å; F282-P294 HydrophobicContact CB-CG 4.17Å
283	K	92.9	Very high	92.6	Very high	117 Å²	117	58.4 Å²	58.4	51%	0.509	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-34.7	-177.8	-178.3	-172.5	173.6	-168.8	0	113.2	D279	D279-K283 HydrophobicContact CB-CB 4.34Å; D279-K283 HydrophobicContact CB-CD 4.28Å; D279-K283 CarbonylContact O-C 3.5Å; D279-K283 WeakPolarHBondContact O-CA 3.45Å; D279-K283 WeakPolarHBondContact O-CB 3.43Å; D279-K283 PolarHBondContact O-N 3.04Å; D279-K283 WeakPolarHBondContact OD1-CD 3.47Å
284	W	90.7	Very high	92.7	Very high	124 Å²	124	56.6 Å²	56.6	47%	0.47	27%	0.269	S	S	.	.	S	Bend	trans	-109.8	-1	-178.2	-50.5	134	0	0	0	114	T231 D279	T231-W284 HydrophobicContact CG2-CB 4.33Å; D279-W284 PolarHBondContact O-N 2.76Å
285	E	86.8	Confident	92.7	Very high	26 Å²	26	58.2 Å²	58.2	12%	0.121	28%	0.277	C	S	.	.			trans	-77.2	142.3	173.3	178.4	59.1	-81.3	0	0	110.8	A232 R250 L281 K287 T288	A232-E285 WeakPolarHBondContact CB-OE2 3.46Å; R250-E285 IonicContact CZ-OE2 3.57Å; R250-E285 IonicContact NE-OE2 3.59Å; R250-E285 PolarHBondContact NE-OE2 2.85Å; R250-E285 IonicContact NH2-OE2 3.89Å; R250-E285 PolarHBondContact NH2-OE2 2.97Å; L281-E285 VanDerWaalsContact O-CB 3.3Å; L281-E285 WeakPolarHBondContact O-CB 3.28Å; E285-K287 PolarHBondContact OE1-N 3.32Å; E285-T288 WeakPolarHBondContact CG-O 3.23Å; E285-T288 PolarHBondContact OE1-N 2.97Å
286	S	80.2	Confident	92.8	Very high	106 Å²	106	54.5 Å²	54.5	74%	0.741	26%	0.263	S	S	*	.	S	Bend	trans	-138.2	-11.8	-177.8	61.6	0	0	0	0	114.1
287	K	85.4	Confident	92.9	Very high	154 Å²	154	54.1 Å²	54.1	67%	0.67	26%	0.26	S	S	*	.	S	Bend	trans	-99.8	-36	178	-63.1	173.9	-176.8	165.7	0	112.8	S233 E285	S233-K287 PolarHBondContact OG-NZ 2.99Å; E285-K287 PolarHBondContact OE1-N 3.32Å
288	T	88.6	Confident	92.9	Very high	36 Å²	36	55.6 Å²	55.6	22%	0.221	27%	0.267	C	S	.	.	S	Bend	trans	-135.3	69.1	-164.9	-50.4	0	0	0	0	110.8	R250 E285 L290	R250-T288 HydrophobicContact CG-CG2 3.67Å; E285-T288 WeakPolarHBondContact CG-O 3.23Å; E285-T288 PolarHBondContact OE1-N 2.97Å; T288-L290 PolarHBondContact O-N 3.49Å
289	V	89.9	Confident	92.8	Very high	113 Å²	113	55.9 Å²	55.9	69%	0.685	27%	0.274	S	S	*	.			trans	-61.2	129.3	179.3	-177.9	0	0	0	0	110.5
290	L	93.4	Very high	92.8	Very high	11 Å²	11	54.8 Å²	54.8	6%	0.058	27%	0.268	C	S	.	.			trans	-79.8	151.1	174.8	-53.5	-179	0	0	0	110.6	R250 V256 L281 F282 T288 P294	R250-L290 HydrophobicContact CB-CD2 3.91Å; R250-L290 HydrophobicContact CG-CD2 3.95Å; R250-L290 WeakPolarHBondContact O-CD2 3.32Å; V256-L290 HydrophobicContact CB-CD1 4.36Å; V256-L290 HydrophobicContact CG2-CD1 4.03Å; V256-L290 HydrophobicContact CG2-CD2 4.1Å; L281-L290 HydrophobicContact CB-CD1 4.16Å; F282-L290 HydrophobicContact CD2-CB 4.23Å; F282-L290 HydrophobicContact CD2-CD1 4.45Å; F282-L290 HydrophobicContact CE2-CB 4.48Å; T288-L290 PolarHBondContact O-N 3.49Å; L290-P294 HydrophobicContact CD1-CG 3.68Å
291	R	91.3	Very high	92.9	Very high	156 Å²	156	54.8 Å²	54.8	59%	0.589	27%	0.268	S	S	*	.	S	Bend	trans	-69	-42.6	176.6	-60.3	-167.1	-167.8	170.8	4.6	112.8	N252 E254	N252-R291 PolarHBondContact O-NH2 2.83Å; E254-R291 IonicContact OE2-NH1 3.23Å
292	N	93.3	Very high	93	Very high	47 Å²	47	56.6 Å²	56.6	25%	0.251	28%	0.277	S	S	.	.	S	Bend	trans	-119.5	158.1	-178.8	-72.1	-73.2	0	0	0	110.9	E254 Y255 F282	E254-N292 PolarHBondContact O-ND2 3.1Å; Y255-N292 HydrophobicContact CD1-CB 4.12Å; Y255-N292 HydrophobicContact CE1-CB 4.22Å; Y255-N292 WeakPolarHBondContact CE1-ND2 3.44Å; F282-N292 WeakPolarHBondContact CE2-O 3.06Å
293	E	94.6	Very high	93.1	Very high	85 Å²	85	54.8 Å²	54.8	40%	0.397	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-63.8	134.5	170.3	-172.7	-175.3	146.9	0	0	110.3	K278 F282 L295	K278-E293 WeakPolarHBondContact CE-OE1 3.28Å; K278-E293 IonicContact NZ-OE1 3.43Å; K278-E293 PolarHBondContact NZ-OE1 3.42Å; F282-E293 HydrophobicContact CD1-CB 4.26Å; F282-E293 HydrophobicContact CD1-CG 3.92Å; F282-E293 HydrophobicContact CE1-CB 3.83Å; F282-E293 HydrophobicContact CE1-CG 3.9Å; F282-E293 HydrophobicContact CE2-CB 4.41Å; F282-E293 HydrophobicContact CG-CG 4.5Å; F282-E293 HydrophobicContact CZ-CB 3.91Å; F282-E293 HydrophobicContact CZ-CG 4.47Å; E293-L295 PolarHBondContact O-N 3.3Å
294	P	96.8	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-57.3	129.3	177.4	-26.4	34	0	0	0	112.7	V256 L258 K278 L281 F282 L290	V256-P294 WeakPolarHBondContact O-CA 3.46Å; L258-P294 HydrophobicContact CD1-CB 3.82Å; L258-P294 HydrophobicContact CD2-CB 4.35Å; L258-P294 HydrophobicContact CG-CB 3.96Å; K278-P294 HydrophobicContact CD-CB 4.45Å; K278-P294 WeakPolarHBondContact CE-O 3.49Å; K278-P294 HydrophobicContact CG-CB 4.25Å; K278-P294 HydrophobicContact CG-CG 4.41Å; K278-P294 PolarHBondContact NZ-O 3.37Å; L281-P294 HydrophobicContact CB-CG 4.23Å; L281-P294 HydrophobicContact CD1-CG 4.41Å; F282-P294 HydrophobicContact CB-CG 4.17Å; L290-P294 HydrophobicContact CD1-CG 3.68Å
295	L	97.4	Very high	93.7	Very high	33 Å²	33	44.3 Å²	44.3	17%	0.173	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	143.4	-179.1	-51.2	179.2	0	0	0	110.2	G181 I183 Y255 V256 V257 L258 E293	G181-L295 CarbonylContact O-C 3.51Å; G181-L295 WeakPolarHBondContact O-CA 3.22Å; I183-L295 HydrophobicContact CB-CB 4.01Å; I183-L295 HydrophobicContact CB-CD1 4.08Å; I183-L295 HydrophobicContact CD1-CD1 4.21Å; I183-L295 HydrophobicContact CG2-CB 3.86Å; Y255-L295 HydrophobicContact CD1-CD1 4.41Å; V256-L295 PolarHBondContact O-N 2.82Å; V257-L295 CarbonylContact C-O 3.53Å; V257-L295 WeakPolarHBondContact CA-O 3.34Å; V257-L295 HydrophobicContact CG2-CB 4.32Å; L258-L295 PolarHBondContact N-O 2.86Å; E293-L295 PolarHBondContact O-N 3.3Å
296	V	98.1	Very high	94.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.4	174.9	-179.6	0	0	0	0	109.9	G181 A182 I183 L258 A265 L268 L274 E298	G181-V296 PolarHBondContact O-N 2.85Å; A182-V296 CarbonylContact C-O 3.35Å; A182-V296 WeakPolarHBondContact CA-O 3.49Å; I183-V296 PolarHBondContact N-O 3.32Å; L258-V296 WeakPolarHBondContact O-CA 3.21Å; A265-V296 HydrophobicContact CB-CB 4.13Å; L268-V296 HydrophobicContact CD1-CG1 4.15Å; L268-V296 HydrophobicContact CD1-CG2 3.86Å; L268-V296 HydrophobicContact CD2-CG2 3.61Å; L268-V296 HydrophobicContact CG-CG2 4.4Å; L274-V296 HydrophobicContact CD1-CG1 4.02Å; V296-E298 PolarHBondContact O-N 2.89Å
297	L	97.9	Very high	95	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	113.2	175.6	177.8	58.6	0	0	0	110.7	I183 A185 L188 I215 V257 L258 L259 G299 G300 W304	I183-L297 WeakPolarHBondContact O-CA 3.32Å; A185-L297 HydrophobicContact CB-CD1 4.2Å; L188-L297 HydrophobicContact CB-CD1 4.38Å; L188-L297 HydrophobicContact CD2-CD1 3.79Å; L188-L297 HydrophobicContact CD2-CD2 3.81Å; L188-L297 HydrophobicContact CD2-CG 4.33Å; I215-L297 HydrophobicContact CD1-CD2 4.35Å; V257-L297 HydrophobicContact CG1-CB 4.24Å; L258-L297 PolarHBondContact O-N 3.09Å; L259-L297 HydrophobicContact CB-CB 3.88Å; L259-L297 HydrophobicContact CB-CD2 3.97Å; L259-L297 HydrophobicContact CD2-CD2 3.85Å; L297-G299 PolarHBondContact O-N 3.46Å; L297-G300 PolarHBondContact O-N 2.89Å; L297-W304 HydrophobicContact CD2-CB 4.32Å; L297-W304 HydrophobicContact CD2-CE3 4.36Å
298	E	97.1	Very high	95.5	Very high	31 Å²	31	42.1 Å²	42.1	15%	0.145	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	123.9	-178.6	-74.1	-65.3	115.4	0	0	112.2	A182 I183 S264 A265 V296 G300 N303	A182-E298 HydrophobicContact CB-CG 4.15Å; I183-E298 PolarHBondContact O-N 3.27Å; S264-E298 WeakPolarHBondContact CA-OE1 3.44Å; S264-E298 VanDerWaalsContact CB-CD 3.45Å; S264-E298 WeakPolarHBondContact CB-OE1 3.18Å; S264-E298 WeakPolarHBondContact CB-OE2 3.36Å; S264-E298 PolarHBondContact OG-OE1 3.27Å; S264-E298 PolarHBondContact OG-OE2 3.46Å; A265-E298 PolarHBondContact N-OE1 3.49Å; V296-E298 PolarHBondContact O-N 2.89Å; E298-G300 VanDerWaalsContact C-N 3.26Å; E298-G300 PolarHBondContact O-N 3.43Å; E298-N303 PolarHBondContact O-ND2 3.16Å
299	G	93.7	Very high	95.9	Very high	19 Å²	19	42.5 Å²	42.5	20%	0.196	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	9.9	-175.8	0	0	0	0	0	115.5	S264 L297 N303	S264-G299 PolarHBondContact OG-N 3.01Å; S264-G299 VanDerWaalsContact OG-N 3.11Å; L297-G299 PolarHBondContact O-N 3.46Å; G299-N303 VanDerWaalsContact O-CB 3.26Å; G299-N303 WeakPolarHBondContact O-CB 3.29Å; G299-N303 PolarHBondContact O-N 2.87Å; G299-N303 VanDerWaalsContact O-N 3.15Å
300	G	96.5	Very high	96.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	56.5	-152.5	173.1	0	0	0	0	0	115.8	D260 L297 E298 N303 W304	D260-G300 CarbonylContact O-C 3.59Å; D260-G300 WeakPolarHBondContact O-CA 3.42Å; L297-G300 PolarHBondContact O-N 2.89Å; E298-G300 VanDerWaalsContact C-N 3.26Å; E298-G300 PolarHBondContact O-N 3.43Å; G300-N303 PolarHBondContact O-N 3.01Å; G300-W304 PolarHBondContact O-N 2.75Å; G300-W304 VanDerWaalsContact O-N 3.16Å
301	Y	97.8	Very high	96.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69	-31.2	-177.5	-162	-115.7	0	0	0	113.2	S213 C214 I215 L259 D260 W261 W304 L305 T312 V317	S213-Y301 PolarHBondContact OG-OH 2.93Å; C214-Y301 VanDerWaalsContact CA-OH 3.27Å; C214-Y301 WeakPolarHBondContact CA-OH 3.37Å; C214-Y301 PolarHBondContact N-OH 3.23Å; C214-Y301 VanDerWaalsContact N-OH 3.14Å; C214-Y301 PolarHBondContact O-OH 3.41Å; I215-Y301 HydrophobicContact CD1-CD2 4.5Å; I215-Y301 HydrophobicContact CG1-CD2 3.95Å; I215-Y301 HydrophobicContact CG1-CE2 3.59Å; L259-Y301 HydrophobicContact CD1-CD2 4.17Å; L259-Y301 HydrophobicContact CD1-CG 4.45Å; D260-Y301 WeakPolarHBondContact O-CB 3.31Å; D260-Y301 PolarHBondContact O-N 3.43Å; W261-Y301 HydrophobicContact CE3-CD1 4.19Å; W261-Y301 HydrophobicContact CH2-CD1 4.19Å; W261-Y301 AromaticContact CZ3-CD1 3.75Å; W261-Y301 HydrophobicContact CZ3-CD1 3.75Å; W261-Y301 PolarHBondContact O-N 2.81Å; Y301-W304 HydrophobicContact CD2-CB 4.47Å; Y301-W304 PolarHBondContact O-N 3.17Å; Y301-L305 HydrophobicContact CD1-CD1 3.71Å; Y301-L305 HydrophobicContact CD1-CG 4.13Å; Y301-L305 HydrophobicContact CE1-CD1 3.65Å; Y301-L305 HydrophobicContact CE1-CD2 4.09Å; Y301-L305 HydrophobicContact CE1-CG 3.86Å; Y301-L305 WeakPolarHBondContact O-CG 3.4Å; Y301-L305 PolarHBondContact O-N 2.76Å; Y301-T312 HydrophobicContact CE2-CG2 4.16Å; Y301-T312 VanDerWaalsContact OH-CB 3.32Å; Y301-T312 WeakPolarHBondContact OH-CB 3.4Å; Y301-T312 VanDerWaalsContact OH-CG2 3.27Å; Y301-T312 WeakPolarHBondContact OH-CG2 3.35Å; Y301-V317 HydrophobicContact CE1-CG1 4.23Å
302	E	96.6	Very high	96.7	Very high	39 Å²	39	39 Å²	39	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-47.6	174.7	-177.4	177.5	-121.7	0	0	111	W261 F262 W304 L305 L306 P319 R322	W261-E302 WeakPolarHBondContact O-CB 3.05Å; W261-E302 PolarHBondContact O-N 3.21Å; F262-E302 HydrophobicContact CD1-CB 3.9Å; F262-E302 HydrophobicContact CD1-CG 4.47Å; F262-E302 VanDerWaalsContact CD1-OE2 3.26Å; F262-E302 WeakPolarHBondContact CD1-OE2 3.4Å; F262-E302 HydrophobicContact CE1-CB 3.97Å; F262-E302 VanDerWaalsContact CE1-CD 3.5Å; F262-E302 HydrophobicContact CE1-CG 4.3Å; F262-E302 WeakPolarHBondContact CE1-OE2 3.24Å; E302-W304 VanDerWaalsContact C-N 3.32Å; E302-W304 PolarHBondContact O-N 3.01Å; E302-L305 PolarHBondContact O-N 3.23Å; E302-L306 WeakPolarHBondContact O-CG 3.41Å; E302-L306 PolarHBondContact O-N 3.16Å; E302-P319 HydrophobicContact CB-CG 4.44Å; E302-P319 HydrophobicContact CG-CG 4.02Å; E302-R322 IonicContact OE2-CZ 3.39Å; E302-R322 IonicContact OE2-NE 3.51Å; E302-R322 PolarHBondContact OE2-NE 3.29Å; E302-R322 IonicContact OE2-NH2 3.25Å; E302-R322 PolarHBondContact OE2-NH2 2.82Å
303	N	96.9	Very high	96.9	Very high	53 Å²	53	40.8 Å²	40.8	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-35.6	175.9	-169.8	36.2	0	0	0	112.1	E298 G299 G300 L306 C307	E298-N303 PolarHBondContact O-ND2 3.16Å; G299-N303 VanDerWaalsContact O-CB 3.26Å; G299-N303 WeakPolarHBondContact O-CB 3.29Å; G299-N303 PolarHBondContact O-N 2.87Å; G299-N303 VanDerWaalsContact O-N 3.15Å; G300-N303 PolarHBondContact O-N 3.01Å; N303-L306 PolarHBondContact O-N 2.78Å; N303-C307 PolarHBondContact O-N 3.41Å
304	W	97.9	Very high	97	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-42.8	173.4	-173.6	-96.1	0	0	0	112.9	A185 L188 M192 I215 L297 G300 Y301 E302 L306 C307 Y308	A185-W304 HydrophobicContact CB-CE3 3.92Å; A185-W304 HydrophobicContact CB-CZ3 4.26Å; A185-W304 WeakPolarHBondContact O-CZ3 3.17Å; L188-W304 HydrophobicContact CB-CZ3 4.05Å; L188-W304 HydrophobicContact CD2-CE3 3.93Å; L188-W304 HydrophobicContact CD2-CH2 4.25Å; L188-W304 HydrophobicContact CD2-CZ3 3.63Å; L188-W304 HydrophobicContact CG-CH2 4.15Å; L188-W304 HydrophobicContact CG-CZ3 3.76Å; M192-W304 HydrophobicContact CE-CZ2 4.45Å; M192-W304 HydrophobicContact SD-CH2 3.57Å; M192-W304 VanDerWaalsContact SD-CH2 3.57Å; M192-W304 HydrophobicContact SD-CZ2 3.85Å; I215-W304 HydrophobicContact CD1-CB 4.41Å; I215-W304 HydrophobicContact CD1-CD2 3.62Å; I215-W304 HydrophobicContact CD1-CE3 4.24Å; I215-W304 HydrophobicContact CD1-CG 3.67Å; I215-W304 HydrophobicContact CD1-CZ2 4.32Å; I215-W304 HydrophobicContact CG1-CD2 4.34Å; I215-W304 HydrophobicContact CG1-CG 4.09Å; I215-W304 HydrophobicContact CG2-CZ2 4.06Å; L297-W304 HydrophobicContact CD2-CB 4.32Å; L297-W304 HydrophobicContact CD2-CE3 4.36Å; G300-W304 PolarHBondContact O-N 2.75Å; G300-W304 VanDerWaalsContact O-N 3.16Å; Y301-W304 HydrophobicContact CD2-CB 4.47Å; Y301-W304 PolarHBondContact O-N 3.17Å; E302-W304 VanDerWaalsContact C-N 3.32Å; E302-W304 PolarHBondContact O-N 3.01Å; W304-L306 VanDerWaalsContact C-N 3.26Å; W304-L306 PolarHBondContact O-N 3.5Å; W304-C307 PolarHBondContact O-N 2.74Å; W304-Y308 HydrophobicContact CD2-CD2 4.45Å; W304-Y308 AromaticContact CE3-CD2 3.95Å; W304-Y308 HydrophobicContact CE3-CD2 3.95Å; W304-Y308 HydrophobicContact CH2-CD2 4.07Å; W304-Y308 HydrophobicContact CH2-CG 4.18Å; W304-Y308 HydrophobicContact CZ2-CG 4.34Å; W304-Y308 AromaticContact CZ3-CD2 3.73Å; W304-Y308 HydrophobicContact CZ3-CD2 3.73Å; W304-Y308 HydrophobicContact CZ3-CE2 4.44Å; W304-Y308 HydrophobicContact CZ3-CG 4.29Å; W304-Y308 CarbonylContact O-C 3.48Å; W304-Y308 WeakPolarHBondContact O-CA 3.48Å; W304-Y308 PolarHBondContact O-N 3.07Å
305	L	97.1	Very high	96.8	Very high	22 Å²	22	42.4 Å²	42.4	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-31.2	175.4	-74.6	163.9	0	0	0	112.7	W261 Y301 E302 P309 T312 V317	W261-L305 HydrophobicContact CZ3-CD1 4.35Å; Y301-L305 HydrophobicContact CD1-CD1 3.71Å; Y301-L305 HydrophobicContact CD1-CG 4.13Å; Y301-L305 HydrophobicContact CE1-CD1 3.65Å; Y301-L305 HydrophobicContact CE1-CD2 4.09Å; Y301-L305 HydrophobicContact CE1-CG 3.86Å; Y301-L305 WeakPolarHBondContact O-CG 3.4Å; Y301-L305 PolarHBondContact O-N 2.76Å; E302-L305 PolarHBondContact O-N 3.23Å; L305-P309 WeakPolarHBondContact O-CB 3.35Å; L305-P309 WeakPolarHBondContact O-CD 3.11Å; L305-T312 HydrophobicContact CD2-CG2 3.99Å; L305-V317 HydrophobicContact CD1-CG1 3.56Å; L305-V317 HydrophobicContact CD2-CG1 4.23Å
306	L	96.4	Very high	96.6	Very high	136 Å²	136	49.8 Å²	49.8	71%	0.712	27%	0.265	S	S	*	.	H	α-helix	trans	-76.4	-37.4	176.2	-65.8	173.3	0	0	0	112.8	E302 N303 W304	E302-L306 WeakPolarHBondContact O-CG 3.41Å; E302-L306 PolarHBondContact O-N 3.16Å; N303-L306 PolarHBondContact O-N 2.78Å; W304-L306 VanDerWaalsContact C-N 3.26Å; W304-L306 PolarHBondContact O-N 3.5Å
307	C	97.3	Very high	96.4	Very high	62 Å²	62	51 Å²	51	42%	0.419	27%	0.272	S	S	.	.	H	α-helix	trans	-89.6	-39	-177.2	-66.4	0	0	0	0	114.6	A185 N303 W304	A185-C307 HydrophobicContact CB-CB 4.27Å; N303-C307 PolarHBondContact O-N 3.41Å; W304-C307 PolarHBondContact O-N 2.74Å
308	Y	97.3	Very high	96	Very high	41 Å²	41	56.8 Å²	56.8	16%	0.161	31%	0.308	C	S	.	.			trans	-139.4	47.7	-167.7	-63.8	-70.6	0	0	0	113.5	A185 Y189 W304 Q310 Y311	A185-Y308 HydrophobicContact CB-CD2 4.07Å; A185-Y308 HydrophobicContact CB-CE2 3.98Å; A185-Y308 VanDerWaalsContact O-CE2 3.31Å; A185-Y308 WeakPolarHBondContact O-CE2 3.45Å; Y189-Y308 AromaticContact CD1-CE1 3.71Å; Y189-Y308 HydrophobicContact CD1-CE1 3.71Å; Y189-Y308 AromaticContact CD1-CZ 3.97Å; Y189-Y308 AromaticContact CD2-CD1 3.96Å; Y189-Y308 HydrophobicContact CD2-CD1 3.96Å; Y189-Y308 AromaticContact CD2-CE1 3.96Å; Y189-Y308 HydrophobicContact CD2-CE1 3.96Å; Y189-Y308 HydrophobicContact CE1-CE1 4.3Å; Y189-Y308 AromaticContact CG-CD1 3.96Å; Y189-Y308 HydrophobicContact CG-CD1 3.96Å; Y189-Y308 AromaticContact CG-CE1 3.51Å; Y189-Y308 HydrophobicContact CG-CE1 3.51Å; Y189-Y308 HydrophobicContact CG-CE2 4.45Å; Y189-Y308 AromaticContact CG-CZ 3.81Å; W304-Y308 HydrophobicContact CD2-CD2 4.45Å; W304-Y308 AromaticContact CE3-CD2 3.95Å; W304-Y308 HydrophobicContact CE3-CD2 3.95Å; W304-Y308 HydrophobicContact CH2-CD2 4.07Å; W304-Y308 HydrophobicContact CH2-CG 4.18Å; W304-Y308 HydrophobicContact CZ2-CG 4.34Å; W304-Y308 AromaticContact CZ3-CD2 3.73Å; W304-Y308 HydrophobicContact CZ3-CD2 3.73Å; W304-Y308 HydrophobicContact CZ3-CE2 4.44Å; W304-Y308 HydrophobicContact CZ3-CG 4.29Å; W304-Y308 CarbonylContact O-C 3.48Å; W304-Y308 WeakPolarHBondContact O-CA 3.48Å; W304-Y308 PolarHBondContact O-N 3.07Å; Y308-Q310 PolarHBondContact O-N 3.13Å; Y308-Q310 VanDerWaalsContact O-N 3.1Å; Y308-Y311 HydrophobicContact CD1-CD2 4.25Å; Y308-Y311 PolarHBondContact O-N 3.29Å
309	P	96.9	Very high	95.7	Very high	45 Å²	45	57.2 Å²	57.2	29%	0.292	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-56.7	-31.3	-176.6	21.9	-32	0	0	0	113.7	L305 Y311 T312 A315	L305-P309 WeakPolarHBondContact O-CB 3.35Å; L305-P309 WeakPolarHBondContact O-CD 3.11Å; P309-Y311 PolarHBondContact O-N 3.42Å; P309-T312 PolarHBondContact O-N 3.26Å; P309-T312 PolarHBondContact O-OG1 2.8Å; P309-A315 HydrophobicContact CB-CB 3.67Å
310	Q	96.8	Very high	95.5	Very high	118 Å²	118	58.3 Å²	58.3	55%	0.551	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-69.8	-8	177.7	75.7	-77.3	14.3	0	0	114.5	Y308	Y308-Q310 PolarHBondContact O-N 3.13Å; Y308-Q310 VanDerWaalsContact O-N 3.1Å
311	Y	97.4	Very high	94.9	Very high	75 Å²	75	64.1 Å²	64.1	29%	0.294	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-106	30.4	173.4	-65.8	-77.6	0	0	0	112.1	Y189 L216 Y308 P309	Y189-Y311 HydrophobicContact CD2-CD2 4.16Å; Y189-Y311 AromaticContact CD2-CE2 3.95Å; Y189-Y311 HydrophobicContact CD2-CE2 3.95Å; Y189-Y311 HydrophobicContact CE2-CD2 4.07Å; Y189-Y311 HydrophobicContact CE2-CE1 4.29Å; Y189-Y311 AromaticContact CE2-CE2 3.39Å; Y189-Y311 HydrophobicContact CE2-CE2 3.39Å; Y189-Y311 AromaticContact CE2-CZ 3.55Å; L216-Y311 PolarHBondContact N-O 3.29Å; L216-Y311 VanDerWaalsContact N-O 3.1Å; Y308-Y311 HydrophobicContact CD1-CD2 4.25Å; Y308-Y311 PolarHBondContact O-N 3.29Å; P309-Y311 PolarHBondContact O-N 3.42Å
312	T	97.6	Very high	94	Very high	14 Å²	14	71.4 Å²	71.4	9%	0.086	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-123.9	162	174.4	69	0	0	0	0	111.5	C214 Y301 L305 P309 A315	C214-T312 CarbonylContact O-C 3.58Å; C214-T312 WeakPolarHBondContact O-CA 3.42Å; C214-T312 WeakPolarHBondContact O-CB 3.43Å; Y301-T312 HydrophobicContact CE2-CG2 4.16Å; Y301-T312 VanDerWaalsContact OH-CB 3.32Å; Y301-T312 WeakPolarHBondContact OH-CB 3.4Å; Y301-T312 VanDerWaalsContact OH-CG2 3.27Å; Y301-T312 WeakPolarHBondContact OH-CG2 3.35Å; L305-T312 HydrophobicContact CD2-CG2 3.99Å; P309-T312 PolarHBondContact O-N 3.26Å; P309-T312 PolarHBondContact O-OG1 2.8Å; T312-A315 PolarHBondContact OG1-N 3.08Å
313	T	97.1	Very high	92.3	Very high	84 Å²	84	81.4 Å²	81.4	52%	0.515	42%	0.418	S	S	.	.	S	Bend	trans	-72.1	-31.4	171.2	53.6	0	0	0	0	112.6	S213 C214 L216	S213-T313 WeakPolarHBondContact CA-OG1 3.24Å; C214-T313 PolarHBondContact N-OG1 3.46Å; C214-T313 PolarHBondContact O-N 2.83Å; L216-T313 HydrophobicContact CD2-CG2 3.92Å
314	N	95.7	Very high	90.2	Very high	63 Å²	63	86.3 Å²	86.3	34%	0.337	44%	0.44	S	S	.	.			trans	-150.8	94.8	-178.7	174	20.2	0	0	0	112.8	D212 S213 K316	D212-N314 WeakPolarHBondContact O-CB 3.26Å; D212-N314 PolarHBondContact O-ND2 2.95Å; S213-N314 WeakPolarHBondContact CB-O 3.28Å; S213-N314 VanDerWaalsContact OG-C 3.28Å; S213-N314 PolarHBondContact OG-N 2.96Å; S213-N314 PolarHBondContact OG-O 3.47Å; N314-K316 PolarHBondContact O-N 2.58Å; N314-K316 PolarHBondContact OD1-N 3.01Å; N314-K316 VanDerWaalsContact OD1-N 3.08Å
315	A	94.3	Very high	87.5	Confident	56 Å²	56	93.1 Å²	93.1	46%	0.463	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	2.4	178.7	0	0	0	0	0	115.7	P309 T312	P309-A315 HydrophobicContact CB-CB 3.67Å; T312-A315 PolarHBondContact OG1-N 3.08Å
316	K	93.1	Very high	85.2	Confident	187 Å²	187	99.6 Å²	99.6	81%	0.813	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	5.9	-176.7	-61.1	-178.9	-178.4	175.4	0	114.1	N314	N314-K316 PolarHBondContact O-N 2.58Å; N314-K316 PolarHBondContact OD1-N 3.01Å; N314-K316 VanDerWaalsContact OD1-N 3.08Å
317	V	94.1	Very high	82.7	Confident	25 Å²	25	100.8 Å²	100.8	15%	0.152	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-62.4	143.2	174.5	70.2	0	0	0	0	110.5	D212 W261 Y301 L305	D212-V317 HydrophobicContact CB-CG2 4.31Å; W261-V317 HydrophobicContact CH2-CG1 4.2Å; W261-V317 HydrophobicContact CH2-CG2 3.99Å; Y301-V317 HydrophobicContact CE1-CG1 4.23Å; L305-V317 HydrophobicContact CD1-CG1 3.56Å; L305-V317 HydrophobicContact CD2-CG1 4.23Å
318	T	89.6	Confident	80.2	Confident	123 Å²	123	103.1 Å²	103.1	76%	0.755	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-97.4	124.4	173	-57.2	0	0	0	0	108.5
319	P	89.1	Confident	77.5	Confident	39 Å²	39	105.8 Å²	105.8	25%	0.253	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-59.1	148.6	175.7	-23.4	33.5	0	0	0	112.1	W261 F262 E302	W261-P319 HydrophobicContact CE3-CB 4.04Å; W261-P319 HydrophobicContact CZ3-CB 3.95Å; W261-P319 HydrophobicContact CZ3-CG 4.17Å; F262-P319 HydrophobicContact CE1-CB 3.89Å; F262-P319 HydrophobicContact CZ-CB 4Å; E302-P319 HydrophobicContact CB-CG 4.44Å; E302-P319 HydrophobicContact CG-CG 4.02Å
320	P	89.9	Confident	75.5	Confident	42 Å²	42	109.8 Å²	109.8	27%	0.273	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-64.8	154	176.3	26.9	-33.8	0	0	0	110.9	W261 F262 R322	W261-P320 HydrophobicContact CD2-CG 3.94Å; W261-P320 HydrophobicContact CG-CG 3.87Å; F262-P320 HydrophobicContact CE2-CG 3.99Å; F262-P320 HydrophobicContact CZ-CG 3.93Å; F262-P320 VanDerWaalsContact CZ-O 3.26Å; F262-P320 WeakPolarHBondContact CZ-O 3.4Å; P320-R322 PolarHBondContact O-N 3.27Å; P320-R322 VanDerWaalsContact O-N 3.14Å
321	P	84.3	Confident	73.2	Confident	122 Å²	122	108.9 Å²	108.9	79%	0.792	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-56.7	122.3	179.1	-25.8	34.9	0	0	0	112	R323	P321-R323 PolarHBondContact O-N 3.13Å
322	R	78.4	Confident	71.2	Confident	154 Å²	154	110.9 Å²	110.9	58%	0.581	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-56.8	130.4	173.6	-71.4	-178.2	172.4	-155.1	0.7	108.9	F262 E302 P320 Q324	F262-R322 HydrophobicContact CD1-CG 4.4Å; F262-R322 HydrophobicContact CD2-CG 4.5Å; F262-R322 HydrophobicContact CE1-CG 4.12Å; F262-R322 HydrophobicContact CE2-CG 4.22Å; F262-R322 HydrophobicContact CZ-CG 4.04Å; E302-R322 IonicContact OE2-CZ 3.39Å; E302-R322 IonicContact OE2-NE 3.51Å; E302-R322 PolarHBondContact OE2-NE 3.29Å; E302-R322 IonicContact OE2-NH2 3.25Å; E302-R322 PolarHBondContact OE2-NH2 2.82Å; P320-R322 PolarHBondContact O-N 3.27Å; P320-R322 VanDerWaalsContact O-N 3.14Å; R322-Q324 PolarHBondContact O-N 3.35Å
323	R	61.2	Low	69.4	Low	249 Å²	249	117.3 Å²	117.3	94%	0.94	62%	0.617	S	S	*	*	S	Bend	trans	-67.4	-3.6	-176.6	-73.8	-78.5	-165.3	156	4.7	114.8	P321	P321-R323 PolarHBondContact O-N 3.13Å
324	Q	52.6	Low	67.5	Low	156 Å²	156	121.3 Å²	121.3	73%	0.729	63%	0.628	S	S	*	*			trans	-104.1	105.9	179.6	-66.7	176	1.9	0	0	109.1	R322 E326	R322-Q324 PolarHBondContact O-N 3.35Å; Q324-E326 PolarHBondContact O-N 3.37Å
325	N	42.5	Very low	65.9	Low	143 Å²	143	124.5 Å²	124.5	77%	0.765	65%	0.65	S	S	*	*			trans	-76.2	67	170.3	-74.4	14	0	0	0	110.3	E327	N325-E327 PolarHBondContact O-N 3.32Å; N325-E327 VanDerWaalsContact O-N 3.12Å
326	E	48.2	Very low	64.5	Low	157 Å²	157	131.6 Å²	131.6	73%	0.734	67%	0.666	S	S	*	*			trans	-79.4	76.1	155	-68.6	-162.2	154.5	0	0	108.1	Q324 V328	Q324-E326 PolarHBondContact O-N 3.37Å; E326-V328 HydrophobicContact CB-CG2 4.41Å; E326-V328 PolarHBondContact O-N 3.16Å
327	E	43.1	Very low	62.9	Low	162 Å²	162	127.9 Å²	127.9	76%	0.757	66%	0.661	S	S	*	*			trans	-68.1	78.5	165.4	-72.7	-172	141.6	0	0	108.7	N325 S329	N325-E327 PolarHBondContact O-N 3.32Å; N325-E327 VanDerWaalsContact O-N 3.12Å; E327-S329 PolarHBondContact O-N 3.32Å; E327-S329 PolarHBondContact O-OG 2.86Å
328	V	44.8	Very low	61.2	Low	110 Å²	110	130.6 Å²	130.6	67%	0.667	68%	0.682	S	S	*	*			trans	-66.1	81.5	169	-174.4	0	0	0	0	107.6	E326 I330	E326-V328 HydrophobicContact CB-CG2 4.41Å; E326-V328 PolarHBondContact O-N 3.16Å; V328-I330 VanDerWaalsContact C-N 3.27Å; V328-I330 HydrophobicContact CG1-CG1 4.39Å; V328-I330 VanDerWaalsContact O-CG1 3.23Å; V328-I330 WeakPolarHBondContact O-CG1 3.44Å; V328-I330 PolarHBondContact O-N 3.45Å
329	S	42	Very low	59.7	Low	98 Å²	98	132.8 Å²	132.8	69%	0.685	69%	0.688	S	S	*	*			trans	-67.6	87.6	175.8	-66.7	0	0	0	0	108.2	E327 S331	E327-S329 PolarHBondContact O-N 3.32Å; E327-S329 PolarHBondContact O-OG 2.86Å; S329-S331 PolarHBondContact O-N 2.88Å
330	I	53.7	Low	58.3	Low	129 Å²	129	137.8 Å²	137.8	66%	0.662	71%	0.708	S	S	*	*			trans	-71.6	79	178.6	-17.4	176.7	0	0	0	108.7	V328 L332	V328-I330 VanDerWaalsContact C-N 3.27Å; V328-I330 HydrophobicContact CG1-CG1 4.39Å; V328-I330 VanDerWaalsContact O-CG1 3.23Å; V328-I330 WeakPolarHBondContact O-CG1 3.44Å; V328-I330 PolarHBondContact O-N 3.45Å; I330-L332 HydrophobicContact CB-CD1 4.35Å; I330-L332 HydrophobicContact CB-CG 4.3Å; I330-L332 HydrophobicContact CG2-CD1 4.19Å; I330-L332 HydrophobicContact CG2-CD2 4.21Å; I330-L332 HydrophobicContact CG2-CG 3.92Å; I330-L332 PolarHBondContact O-N 3.08Å
331	S	48.7	Very low	57	Low	99 Å²	99	144.9 Å²	144.9	69%	0.692	74%	0.737	S	S	*	*			trans	-69.9	78.6	173.9	58.2	0	0	0	0	109.5	S329 D333	S329-S331 PolarHBondContact O-N 2.88Å; S331-D333 PolarHBondContact O-N 3.47Å
332	L	56.3	Low	55.3	Low	117 Å²	117	144.3 Å²	144.3	61%	0.613	74%	0.736	S	S	*	*			trans	-77	66.4	-179.2	-73.3	162.5	0	0	0	110.7	I330 F334	I330-L332 HydrophobicContact CB-CD1 4.35Å; I330-L332 HydrophobicContact CB-CG 4.3Å; I330-L332 HydrophobicContact CG2-CD1 4.19Å; I330-L332 HydrophobicContact CG2-CD2 4.21Å; I330-L332 HydrophobicContact CG2-CG 3.92Å; I330-L332 PolarHBondContact O-N 3.08Å; L332-F334 HydrophobicContact CB-CD2 4.33Å; L332-F334 HydrophobicContact CD2-CD2 3.87Å; L332-F334 HydrophobicContact CD2-CE2 3.68Å; L332-F334 PolarHBondContact O-N 2.83Å
333	D	58.2	Low	53.7	Low	148 Å²	148	144.4 Å²	144.4	79%	0.791	75%	0.747	S	S	*	*			trans	-71.6	56.2	172.8	-80	-13.5	0	0	0	111.6	S331 T335	S331-D333 PolarHBondContact O-N 3.47Å; D333-T335 VanDerWaalsContact C-N 3.29Å; D333-T335 PolarHBondContact O-N 3Å
334	F	58.1	Low	52.7	Low	168 Å²	168	138.4 Å²	138.4	74%	0.737	74%	0.74	S	S	*	*			trans	-79.7	77.3	169.9	-84.5	-73.3	0	0	0	110.2	L332 Y336	L332-F334 HydrophobicContact CB-CD2 4.33Å; L332-F334 HydrophobicContact CD2-CD2 3.87Å; L332-F334 HydrophobicContact CD2-CE2 3.68Å; L332-F334 PolarHBondContact O-N 2.83Å; F334-Y336 VanDerWaalsContact C-N 3.33Å; F334-Y336 PolarHBondContact O-N 3.28Å
335	T	61.9	Low	52.1	Low	130 Å²	130	136.5 Å²	136.5	80%	0.798	74%	0.744	S	S	*	*			trans	-65.9	92.9	166.7	-59.7	0	0	0	0	109.5	D333	D333-T335 VanDerWaalsContact C-N 3.29Å; D333-T335 PolarHBondContact O-N 3Å
336	Y	64.3	Low	51.8	Low	205 Å²	205	139.1 Å²	139.1	80%	0.804	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-65.4	130.2	171.6	-122.9	-91	0	0	0	109.6	F334 S338	F334-Y336 VanDerWaalsContact C-N 3.33Å; F334-Y336 PolarHBondContact O-N 3.28Å; Y336-S338 PolarHBondContact O-N 3.37Å
337	P	60.2	Low	51.4	Low	109 Å²	109	137.4 Å²	137.4	71%	0.708	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-61.3	126.9	169.5	-21.3	33.3	0	0	0	110.2
338	S	57.3	Low	51.1	Low	83 Å²	83	134.6 Å²	134.6	58%	0.58	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-66.6	148.9	165.1	134.5	0	0	0	0	109.2	Y336 E340	Y336-S338 PolarHBondContact O-N 3.37Å; S338-E340 VanDerWaalsContact C-N 3.28Å; S338-E340 WeakPolarHBondContact CB-OE2 3.2Å; S338-E340 PolarHBondContact OG-N 2.74Å; S338-E340 PolarHBondContact OG-OE2 2.88Å
339	L	59.4	Low	50.7	Low	169 Å²	169	134 Å²	134	89%	0.885	76%	0.762	S	S	*	*	S	Bend	trans	-93.6	14.6	-178.9	-74.9	167.9	0	0	0	112.3
340	E	60.3	Low	50.6	Low	144 Å²	144	138.2 Å²	138.2	67%	0.673	77%	0.771	S	S	*	*			trans	-100.4	85.2	176.8	-66.2	76.9	-162.1	0	0	110.3	S338 S342	S338-E340 VanDerWaalsContact C-N 3.28Å; S338-E340 WeakPolarHBondContact CB-OE2 3.2Å; S338-E340 PolarHBondContact OG-N 2.74Å; S338-E340 PolarHBondContact OG-OE2 2.88Å; E340-S342 PolarHBondContact O-N 2.72Å
341	E	60.6	Low	49.6	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	78%	0.78	S	S	*	*			trans	-65.7	93.9	174.2	-172.6	175	-170.5	0	0	110.8	I343	E341-I343 PolarHBondContact O-N 3.36Å
342	S	48.8	Very low	49.2	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	78%	0.782	S	S	*	*			trans	-79.1	113.2	-179.9	56.1	0	0	0	0	111.5	E340	E340-S342 PolarHBondContact O-N 2.72Å
343	I	45.3	Very low	48.4	Very low	156 Å²	156	140 Å²	140	80%	0.8	79%	0.793	S	S	*	*			trans	-54.2	129.9	-177.4	-59.8	165.4	0	0	0	110.5	E341 S345	E341-I343 PolarHBondContact O-N 3.36Å; I343-S345 PolarHBondContact O-N 2.76Å; I343-S345 VanDerWaalsContact O-N 3.16Å
344	P	41.3	Very low	47.1	Very low	122 Å²	122	137.9 Å²	137.9	79%	0.792	80%	0.796	S	S	*	*			trans	-67.6	114.9	-176	25.9	-34.5	0	0	0	112.1
345	S	39.2	Very low	45.7	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.9	127.5	174.3	56.3	0	0	0	0	111.7	I343	I343-S345 PolarHBondContact O-N 2.76Å; I343-S345 VanDerWaalsContact O-N 3.16Å
346	K	36.9	Very low	44.3	Very low	197 Å²	197	136.2 Å²	136.2	86%	0.857	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.7	137.9	-178.4	-173.7	-179.9	-177.9	179.6	0	112.7
347	P	39.3	Very low	42.8	Very low	121 Å²	121	134.3 Å²	134.3	79%	0.786	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.7	144.4	178.9	27.9	-35.2	0	0	0	112.5
348	A	36.5	Very low	41.4	Very low	103 Å²	103	135 Å²	135	85%	0.851	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.4	157.6	173.8	0	0	0	0	0	112
349	A	36.2	Very low	40	Very low	97 Å²	97	137.7 Å²	137.7	80%	0.802	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.4	160.3	-172.5	0	0	0	0	0	114.1
350	Q	40.5	Very low	38.6	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-85.8	150.5	175.2	-58.5	169.6	-0.2	0	0	111.7
351	T	31.7	Very low	37.2	Very low	139 Å²	139	138.6 Å²	138.6	85%	0.853	81%	0.81	S	S	*	*			trans	-156.6	162.4	162	10.8	0	0	0	0	109.1
352	P	40.2	Very low	36	Very low	114 Å²	114	137 Å²	137	74%	0.74	81%	0.806	S	S	*	*				-116.5	171.3	-126.7	26.1	-5.9	0	0	0	115.8
353	P	40.8	Very low	35.2	Very low	130 Å²	130	139.2 Å²	139.2	84%	0.844	80%	0.804	S	S	*	*			trans	-81.9	159.9	-179.8	33.9	-36.9	0	0	0	114.6
354	A	30.4	Very low	34.5	Very low	103 Å²	103	138.7 Å²	138.7	85%	0.851	80%	0.802	S	S	*	*			trans	-141.7	169.2	166.7	0	0	0	0	0	109.8
355	S	28.8	Very low	34	Very low	104 Å²	104	140 Å²	140	73%	0.727	80%	0.801	S	S	*	*			trans	-151.7	136.2	-144.9	54.9	0	0	0	0	117
356	I	33	Very low	33.5	Very low	159 Å²	159	140 Å²	140	82%	0.815	80%	0.801	S	S	*	*			trans	55	172.2	164.3	29.7	170.1	0	0	0	117.1
357	E	32.1	Very low	33.2	Very low	165 Å²	165	133.4 Å²	133.4	77%	0.771	79%	0.789	S	S	*	*			cis	-130.5	138.5	10.5	-71.3	-177.6	106.9	0	0	110.6
358	V	31.1	Very low	33	Very low	122 Å²	122	136.8 Å²	136.8	74%	0.739	79%	0.794	S	S	*	*				88	160.3	96.5	179	0	0	0	0	115.7
359	D	27.5	Very low	32.7	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	79%	0.787	S	S	*	*			trans	86.2	139.7	166.2	-118.9	49.6	0	0	0	119.1
360	E	30.5	Very low	32.5	Very low	169 Å²	169	141.7 Å²	141.7	79%	0.79	79%	0.787	S	S	*	*			cis	-157.3	176.3	-44.9	-128.4	-168.1	-165.8	0	0	108.2
361	N	31.4	Very low	32	Very low	163 Å²	163	142.5 Å²	142.5	87%	0.872	78%	0.782	S	S	*	*			trans	-140.6	142.3	177.7	-107.4	-48.9	0	0	0	112.1
362	I	35	Very low	31.9	Very low	158 Å²	158	143.3 Å²	143.3	81%	0.81	78%	0.778	S	S	*	*			trans	-94.2	128.6	-162.2	-67.8	175	0	0	0	114.5
363	E	31.1	Very low	31.3	Very low	155 Å²	155	141.3 Å²	141.3	72%	0.724	78%	0.778	S	S	*	*			trans	32.6	123.9	151	-63.5	-168.4	114.1	0	0	124.8
364	L	31.7	Very low	31.4	Very low	145 Å²	145	140.9 Å²	140.9	76%	0.759	78%	0.775	S	S	*	*				60.4	165.9	119.8	-50.8	174.6	0	0	0	120
365	I	30.9	Very low	31.4	Very low	150 Å²	150	142.8 Å²	142.8	77%	0.769	77%	0.77	S	S	*	*			cis	-143	156.3	19.6	-69.1	172.4	0	0	0	111
366	S	29	Very low	31.3	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	78%	0.778	S	S	*	*			trans	5	154	154.1	-153.4	0	0	0	0	122
367	G	28.8	Very low	31.2	Very low	59 Å²	59	144.7 Å²	144.7	61%	0.608	77%	0.773	S	S	*	*			cis	138.5	148.7	1.2	0	0	0	0	0	113.6
368	Q	35.9	Very low	31	Very low	191 Å²	191	142.4 Å²	142.4	89%	0.893	78%	0.775	S	S	*	*			trans	66.1	161.2	-176.2	-57.2	-173	-35.1	0	0	115.5
369	N	29.8	Very low	31	Very low	134 Å²	134	142.9 Å²	142.9	72%	0.717	78%	0.778	S	S	*	*			cis	-144.9	177.2	4.9	-156.1	9.6	0	0	0	113.3
370	E	31.6	Very low	31.7	Very low	169 Å²	169	141.4 Å²	141.4	79%	0.79	78%	0.776	S	S	*	*			trans	-66	167.1	175.5	-48	177.5	131.3	0	0	115.2
371	R	30.2	Very low	31.6	Very low	206 Å²	206	140 Å²	140	78%	0.777	78%	0.779	S	S	*	*				159.7	127.7	107.2	-169.7	171.5	-156.3	-144.7	4.4	116.2
372	M	30.4	Very low	31.6	Very low	156 Å²	156	140 Å²	140	77%	0.768	77%	0.774	S	S	*	*			trans	63	141.4	155.4	-72	166.8	171.5	0	0	122.1
373	G	27.1	Very low	31.7	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	77%	0.77	S	S	*	*			trans	-100	-144.1	157.2	0	0	0	0	0	111.1
374	P	43.4	Very low	31.6	Very low	121 Å²	121	136.3 Å²	136.3	79%	0.786	77%	0.771	S	S	*	*			cis	-136.7	-179.6	10.4	43.9	-26.7	0	0	0	116.4
375	L	29.6	Very low	31.4	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	77%	0.771	S	S	*	*			trans	10.3	135.5	148	-63.4	165.4	0	0	0	120.3
376	N	27	Very low	31.2	Very low	164 Å²	164	131.1 Å²	131.1	88%	0.877	77%	0.771	S	S	*	*				-160	168.7	113.4	-110.4	-52.4	0	0	0	114.5
377	I	32.1	Very low	31.1	Very low	139 Å²	139	130.7 Å²	130.7	71%	0.713	77%	0.768	S	S	*	*			trans	-120.4	144.5	-167.5	-64	158	0	0	0	110
378	S	26.6	Very low	31.1	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	78%	0.78	S	S	*	*			trans	175.7	141.4	134.6	-80.2	0	0	0	0	114.7
379	T	31	Very low	30.7	Very low	133 Å²	133	133.6 Å²	133.6	82%	0.816	78%	0.775	S	S	*	*			trans	-86.5	-169.1	157.4	48.4	0	0	0	0	108.7
380	P	43.1	Very low	30.7	Very low	110 Å²	110	134.5 Å²	134.5	71%	0.714	78%	0.78	S	S	*	*			cis	-145.7	-154.9	11.5	37.5	-11.5	0	0	0	115.9
381	V	28.2	Very low	30.7	Very low	138 Å²	138	132.5 Å²	132.5	84%	0.836	78%	0.779	S	S	*	*			trans	101.7	135.1	160.4	-170.6	0	0	0	0	117.5
382	E	31	Very low	30.8	Very low	165 Å²	165	127.6 Å²	127.6	77%	0.771	78%	0.777	S	S	*	*			trans	-119	150.2	175.9	-164.2	-159.8	161.8	0	0	108.2
383	P	37.6	Very low	31	Very low	112 Å²	112	126 Å²	126	73%	0.727	78%	0.778	S	S	*	*				-154.9	142.7	111.4	35.6	-16.3	0	0	0	118
384	V	28.6	Very low	31.2	Very low	122 Å²	122	129.8 Å²	129.8	74%	0.739	78%	0.78	S	S	*	*			trans	61.1	103.4	134.5	-174.8	0	0	0	0	120.9
385	A	27.1	Very low	30.8	Very low	94 Å²	94	131.8 Å²	131.8	78%	0.777	78%	0.782	S	S	*	*			trans	45.1	123.5	136.5	0	0	0	0	0	123.2
386	A	26.3	Very low	31.1	Very low	92 Å²	92	132.6 Å²	132.6	76%	0.76	78%	0.782	S	S	*	*				177.1	155.2	94.3	0	0	0	0	0	115.5
387	S	28	Very low	31.5	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	78%	0.778	S	S	*	*			trans	76.4	87.6	149.7	-61.7	0	0	0	0	123.8
388	K	28	Very low	31.6	Very low	197 Å²	197	130.4 Å²	130.4	86%	0.857	78%	0.783	S	S	*	*			trans	74.9	147.8	132.5	-62.2	-157.3	176.4	-169.5	0	122.9
389	S	28.3	Very low	32	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	78%	0.779	S	S	*	*			trans	58.8	125.8	172.9	33.3	0	0	0	0	115.5
390	D	29.4	Very low	32.2	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	78%	0.775	S	S	*	*			cis	-144.8	177.3	38.4	-135.5	-28.7	0	0	0	116.3
391	V	31.4	Very low	32	Very low	127 Å²	127	131 Å²	131	77%	0.77	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.1	132.7	-174.5	175.5	0	0	0	0	113.9
392	S	33.4	Very low	32.7	Very low	104 Å²	104	133.2 Å²	133.2	73%	0.727	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-95.9	141.3	163.7	-67.2	0	0	0	0	111.3
393	P	33.9	Very low	33.2	Very low	121 Å²	121	132.8 Å²	132.8	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.1	138.2	-172	29.1	-35.1	0	0	0	113.8
394	I	30.8	Very low	33.7	Very low	153 Å²	153	133.3 Å²	133.3	79%	0.785	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76	123.7	172.1	-69.4	167.7	0	0	0	109.6	Q396	I394-Q396 HydrophobicContact CG2-CG 4.36Å; I394-Q396 PolarHBondContact O-N 2.95Å
395	I	35.3	Very low	34.2	Very low	162 Å²	162	132.8 Å²	132.8	83%	0.831	78%	0.78	S	S	*	*			trans	-81	109.3	168.9	-60.4	175.3	0	0	0	108.3
396	Q	35.5	Very low	35.2	Very low	161 Å²	161	137.5 Å²	137.5	75%	0.752	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-81.7	137.8	171.8	-67.7	-175.4	-10	0	0	110.8	I394	I394-Q396 HydrophobicContact CG2-CG 4.36Å; I394-Q396 PolarHBondContact O-N 2.95Å
397	P	35.6	Very low	36.4	Very low	123 Å²	123	139.9 Å²	139.9	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.7	131.5	171.7	29.6	-33.1	0	0	0	111.1
398	V	34.5	Very low	37.6	Very low	133 Å²	133	140.2 Å²	140.2	81%	0.806	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73	134.8	-179.7	177.9	0	0	0	0	110.8	S400	V398-S400 PolarHBondContact O-N 3.49Å
399	P	35.7	Very low	39	Very low	112 Å²	112	141.7 Å²	141.7	73%	0.727	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-70	121.4	177.4	27.8	-34.4	0	0	0	111.9	I401	P399-I401 PolarHBondContact O-N 3.01Å
400	S	34.7	Very low	40.1	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	77%	0.773	S	S	*	*			trans	-79.8	103.3	177.6	47	0	0	0	0	111.7	V398 K402	V398-S400 PolarHBondContact O-N 3.49Å; S400-K402 PolarHBondContact O-N 3.19Å; S400-K402 VanDerWaalsContact O-N 3.14Å
401	I	38.2	Very low	41.3	Very low	153 Å²	153	143.9 Å²	143.9	79%	0.785	78%	0.775	S	S	*	*			trans	-69	109.3	177.9	-57.1	175.9	0	0	0	109.6	P399 N403	P399-I401 PolarHBondContact O-N 3.01Å; I401-N403 PolarHBondContact O-N 3.42Å
402	K	42.9	Very low	42.4	Very low	185 Å²	185	146.9 Å²	146.9	80%	0.804	78%	0.778	S	S	*	*			trans	-80	105.5	171.3	-67	-176.5	179.8	-179.2	0	109.6	S400 V404	S400-K402 PolarHBondContact O-N 3.19Å; S400-K402 VanDerWaalsContact O-N 3.14Å; K402-V404 PolarHBondContact O-N 3.02Å
403	N	41.2	Very low	42.6	Very low	156 Å²	156	147.6 Å²	147.6	83%	0.834	78%	0.78	S	S	*	*			trans	-65	117.3	170.6	-87.5	-32.5	0	0	0	110.4	I401	I401-N403 PolarHBondContact O-N 3.42Å
404	V	48.6	Very low	42.9	Very low	123 Å²	123	146.6 Å²	146.6	75%	0.745	78%	0.782	S	S	*	*			trans	-98.3	126	172.9	178.9	0	0	0	0	108.5	K402 Q406	K402-V404 PolarHBondContact O-N 3.02Å; V404-Q406 PolarHBondContact O-N 2.85Å; V404-Q406 VanDerWaalsContact O-N 3.13Å
405	P	39.8	Very low	42.9	Very low	112 Å²	112	145.9 Å²	145.9	73%	0.727	79%	0.785	S	S	*	*			trans	-61.4	114.2	175.4	-24.8	35.2	0	0	0	112	I407	P405-I407 PolarHBondContact O-N 3.21Å
406	Q	47	Very low	42.8	Very low	193 Å²	193	147.3 Å²	147.3	90%	0.902	79%	0.785	S	S	*	*			trans	-79.7	105.5	178.9	-177.5	175.3	-15.4	0	0	110.4	V404 D408	V404-Q406 PolarHBondContact O-N 2.85Å; V404-Q406 VanDerWaalsContact O-N 3.13Å; Q406-D408 PolarHBondContact O-N 3.49Å
407	I	52.8	Low	42.7	Very low	141 Å²	141	147.7 Å²	147.7	72%	0.723	79%	0.791	S	S	*	*			trans	-83.8	109.3	180	-60.2	171.9	0	0	0	110.1	P405	P405-I407 PolarHBondContact O-N 3.21Å
408	D	52.5	Low	42.5	Very low	116 Å²	116	147.8 Å²	147.8	62%	0.62	79%	0.792	S	S	*	*			trans	-65.6	135.7	167.7	-173.5	-5.8	0	0	0	110.6	Q406 T410	Q406-D408 PolarHBondContact O-N 3.49Å; D408-T410 VanDerWaalsContact CG-OG1 3.25Å; D408-T410 WeakPolarHBondContact OD1-CB 3.35Å; D408-T410 VanDerWaalsContact OD1-CG2 3.23Å; D408-T410 WeakPolarHBondContact OD1-CG2 3.47Å; D408-T410 PolarHBondContact OD1-N 2.91Å; D408-T410 PolarHBondContact OD1-OG1 3.39Å; D408-T410 PolarHBondContact OD2-OG1 3.24Å
409	R	57	Low	42.3	Very low	227 Å²	227	150.6 Å²	150.6	86%	0.857	80%	0.796	S	S	*	*			trans	-109.9	4.5	-178.7	-71.4	-176.5	168.9	-176.6	-2.8	113.8	K411	R409-K411 VanDerWaalsContact C-N 3.28Å; R409-K411 PolarHBondContact O-N 3.31Å
410	T	51.1	Low	42.1	Very low	112 Å²	112	153.3 Å²	153.3	69%	0.687	80%	0.799	S	S	*	*	S	Bend	trans	-71.8	-10.5	-173	56.8	0	0	0	0	115.4	D408	D408-T410 VanDerWaalsContact CG-OG1 3.25Å; D408-T410 WeakPolarHBondContact OD1-CB 3.35Å; D408-T410 VanDerWaalsContact OD1-CG2 3.23Å; D408-T410 WeakPolarHBondContact OD1-CG2 3.47Å; D408-T410 PolarHBondContact OD1-N 2.91Å; D408-T410 PolarHBondContact OD1-OG1 3.39Å; D408-T410 PolarHBondContact OD2-OG1 3.24Å
411	K	55.9	Low	41.9	Very low	201 Å²	201	157.6 Å²	157.6	87%	0.874	81%	0.807	S	S	*	*			trans	-119.4	77.5	178.7	-66.4	-167	178.2	-177.6	0	113.1	R409	R409-K411 VanDerWaalsContact C-N 3.28Å; R409-K411 PolarHBondContact O-N 3.31Å
412	K	52.9	Low	41.5	Very low	191 Å²	191	160.4 Å²	160.4	83%	0.83	81%	0.808	S	S	*	*			trans	-106.1	126.3	169.2	-163.9	175.8	-175	-176.8	0	109.9	A414	K412-A414 PolarHBondContact O-N 3.15Å
413	P	39.1	Very low	40.9	Very low	118 Å²	118	159.1 Å²	159.1	77%	0.766	81%	0.808	S	S	*	*			trans	-64.3	134	177.6	-21.8	33.3	0	0	0	111.9
414	A	38.7	Very low	40.3	Very low	100 Å²	100	159.9 Å²	159.9	83%	0.826	80%	0.804	S	S	*	*			trans	-87.5	109	175.2	0	0	0	0	0	110.6	K412	K412-A414 PolarHBondContact O-N 3.15Å
415	V	32.5	Very low	39.3	Very low	138 Å²	138	158.5 Å²	158.5	84%	0.836	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.9	125.8	169.3	179.4	0	0	0	0	108.4
416	K	32	Very low	38.6	Very low	192 Å²	192	162.3 Å²	162.3	84%	0.835	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.8	134.5	178.3	-63.3	-175.3	178.3	-174.9	0	110.7
417	L	33.3	Very low	37.7	Very low	169 Å²	169	158 Å²	158	89%	0.885	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.2	132.4	157.8	-71.7	169.5	0	0	0	108.6
418	P	32	Very low	36.4	Very low	126 Å²	126	157.3 Å²	157.3	82%	0.818	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.4	152.8	164.5	-19.4	33.8	0	0	0	111.8
419	E	29.3	Very low	35.2	Very low	192 Å²	192	158.4 Å²	158.4	90%	0.897	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-95.1	171.7	-171.3	-152.5	167.8	154.5	0	0	112.9
420	E	32	Very low	33.8	Very low	169 Å²	169	155.2 Å²	155.2	79%	0.79	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.7	151	-168.5	-54.2	-177.5	119	0	0	115.4
421	H	31.6	Very low	32.7	Very low	196 Å²	196	156.8 Å²	156.8	91%	0.907	80%	0.801	S	S	*	*			trans	-128.9	70.5	159.2	-88.4	-66.7	0	0	0	113.9
422	R	28.2	Very low	31.4	Very low	212 Å²	212	153.8 Å²	153.8	80%	0.8	79%	0.79	S	S	*	*			trans	-16.2	114.7	153	-179.8	-155.4	-156.7	-178.3	10.6	118.9
423	I	31	Very low	30.3	Very low	158 Å²	158	153 Å²	153	81%	0.81	79%	0.79	S	S	*	*			trans	-148.6	110.7	146.6	-33.7	170.6	0	0	0	105.5
424	K	28.6	Very low	29.7	Very low	172 Å²	172	152.7 Å²	152.7	75%	0.748	79%	0.79	S	S	*	*				42.9	140.5	82.8	-78.5	-165.1	175.1	-164.6	0	114.8
425	S	27.2	Very low	29.7	Very low	94 Å²	94	153.1 Å²	153.1	66%	0.657	79%	0.785	S	S	*	*			cis	-177	170.9	-22.8	41.4	0	0	0	0	108.2
426	E	26.8	Very low	29.6	Very low	191 Å²	191	156.1 Å²	156.1	89%	0.893	79%	0.79	S	S	*	*			trans	74.3	176	169.3	-83	177.2	125.3	0	0	119.2
427	S	26.8	Very low	29.6	Very low	102 Å²	102	152.8 Å²	152.8	71%	0.713	79%	0.79	S	S	*	*			trans	-140	165.1	-142.2	52.7	0	0	0	0	114.1
428	T	26.1	Very low	29.5	Very low	128 Å²	128	147.9 Å²	147.9	79%	0.785	78%	0.781	S	S	*	*				169.4	166.2	124	-67.6	0	0	0	0	111.4
429	N	26.7	Very low	29.8	Very low	138 Å²	138	151.9 Å²	151.9	74%	0.738	79%	0.786	S	S	*	*			trans	-61.4	172.2	-167.4	-57.2	-50.3	0	0	0	119.4
430	H	28.4	Very low	30.1	Very low	161 Å²	161	149 Å²	149	75%	0.745	78%	0.781	S	S	*	*			trans	102.1	112.2	145.7	-87.8	-82.9	0	0	0	121.3
431	E	28.3	Very low	30.8	Very low	144 Å²	144	148.2 Å²	148.2	67%	0.673	78%	0.78	S	S	*	*			trans	81.5	129.9	134.2	-90.6	-175.3	99.5	0	0	125.6
432	Q	28.9	Very low	31.2	Very low	138 Å²	138	143.7 Å²	143.7	65%	0.645	77%	0.769	S	S	*	*			trans	88.1	135.5	136.7	-81.1	-166.5	44.6	0	0	123.2
433	Q	28.5	Very low	32	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	77%	0.766	S	S	*	*			trans	77.4	141.3	155	-68.1	174.2	40.9	0	0	120.2
434	S	26.8	Very low	32.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	77%	0.769	S	S	*	*			trans	-127.4	-173.5	178.4	67.4	0	0	0	0	107
435	P	39.7	Very low	33.6	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	77%	0.768	S	S	*	*			cis	-127.6	169.1	-11.9	40	-26.9	0	0	0	112.9
436	Q	30.4	Very low	34.5	Very low	200 Å²	200	142 Å²	142	94%	0.935	77%	0.773	S	S	*	*			trans	-159.8	158.2	136.9	-116.3	170.5	28.9	0	0	113.6
437	S	30.6	Very low	35.1	Very low	122 Å²	122	142.2 Å²	142.2	85%	0.853	77%	0.771	S	S	*	*			trans	-87.3	126.6	-167.9	52.7	0	0	0	0	113.6
438	G	31.1	Very low	35.6	Very low	67 Å²	67	143 Å²	143	69%	0.691	77%	0.774	S	S	*	*			trans	-142.4	143.8	168.8	0	0	0	0	0	111.2	V440	G438-V440 PolarHBondContact O-N 2.86Å
439	K	38.3	Very low	36.3	Very low	210 Å²	210	142.8 Å²	142.8	91%	0.913	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.5	121.8	-179.1	-72.5	177.3	176.7	175.7	0	110.8
440	V	35.3	Very low	36.6	Very low	132 Å²	132	142.6 Å²	142.6	80%	0.8	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-77.1	121.4	167	179	0	0	0	0	109.1	G438	G438-V440 PolarHBondContact O-N 2.86Å
441	I	48.2	Very low	36.9	Very low	151 Å²	151	143.5 Å²	143.5	77%	0.774	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-94.3	120	164.8	-60	174.9	0	0	0	106.5	D443	I441-D443 PolarHBondContact O-N 3.44Å
442	P	40.1	Very low	37.2	Very low	102 Å²	102	141.1 Å²	141.1	66%	0.662	78%	0.777	S	S	*	*			trans	-68.8	115	177.5	-20.7	33.5	0	0	0	111.3
443	D	44.3	Very low	37.7	Very low	140 Å²	140	141 Å²	141	75%	0.749	79%	0.788	S	S	*	*			trans	-60.1	142	164.9	-173.5	1.5	0	0	0	109.8	I441 S445	I441-D443 PolarHBondContact O-N 3.44Å; D443-S445 WeakPolarHBondContact OD1-CB 3.22Å; D443-S445 PolarHBondContact OD1-N 3.42Å
444	R	44.6	Very low	38.4	Very low	231 Å²	231	138.7 Å²	138.7	87%	0.872	79%	0.786	S	S	*	*			trans	-118.2	17.6	179.5	-70.8	-171.3	170.8	-165.4	-3	113	T446	R444-T446 PolarHBondContact O-N 3.01Å; R444-T446 VanDerWaalsContact O-N 3.1Å
445	S	48.1	Very low	39.2	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	79%	0.787	S	S	*	*			trans	-71.6	6.2	-179.3	-150.5	0	0	0	0	115.5	D443	D443-S445 WeakPolarHBondContact OD1-CB 3.22Å; D443-S445 PolarHBondContact OD1-N 3.42Å
446	T	46.2	Very low	39.7	Very low	125 Å²	125	143.5 Å²	143.5	77%	0.767	79%	0.793	S	S	*	*	S	Bend	trans	-119.2	119.8	176.8	-44.4	0	0	0	0	110.9	R444	R444-T446 PolarHBondContact O-N 3.01Å; R444-T446 VanDerWaalsContact O-N 3.1Å
447	K	38.7	Very low	41	Very low	195 Å²	195	138.3 Å²	138.3	85%	0.848	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.8	173.8	-71.2	178.9	177.5	177.5	0	110.4
448	P	38.2	Very low	43.1	Very low	118 Å²	118	136.2 Å²	136.2	77%	0.766	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-66	139.4	165.3	29.1	-33.3	0	0	0	109.8
449	V	39.9	Very low	44.8	Very low	125 Å²	125	138.7 Å²	138.7	76%	0.758	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-72.9	132.6	171.7	176.7	0	0	0	0	108.7	F451	V449-F451 PolarHBondContact O-N 3.34Å
450	V	34.3	Very low	46.4	Very low	134 Å²	134	134.5 Å²	134.5	81%	0.812	74%	0.735	S	S	*	*			trans	-76	114.2	178.6	179.5	0	0	0	0	109.3
451	F	35.1	Very low	48.1	Very low	180 Å²	180	132 Å²	132	79%	0.789	71%	0.714	S	S	*	*			trans	-76.8	127.6	165.4	-72.9	-84	0	0	0	109.8	V449	V449-F451 PolarHBondContact O-N 3.34Å
452	S	33.3	Very low	49.4	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	69%	0.694	S	S	*	*			trans	-76.6	143.8	175.4	41.3	0	0	0	0	111.4	T454	S452-T454 VanDerWaalsContact C-N 3.25Å; S452-T454 PolarHBondContact O-N 2.91Å
453	P	40.5	Very low	51.1	Low	134 Å²	134	126.4 Å²	126.4	87%	0.87	68%	0.684	S	S	*	*	S	Bend	trans	-81.6	60.2	-171.9	34.6	-37.5	0	0	0	112.7
454	T	43.3	Very low	52.6	Low	128 Å²	128	127 Å²	127	79%	0.785	68%	0.676	S	S	*	*			trans	-146.7	61.6	173.1	-40.5	0	0	0	0	112	S452	S452-T454 VanDerWaalsContact C-N 3.25Å; S452-T454 PolarHBondContact O-N 2.91Å
455	L	42.7	Very low	54.2	Low	150 Å²	150	120.1 Å²	120.1	79%	0.785	66%	0.656	S	S	*	*			trans	-125.5	104	166.7	-105.3	152.2	0	0	0	108.4	L457	L455-L457 PolarHBondContact O-N 3.33Å
456	M	50.4	Low	55.5	Low	172 Å²	172	121.7 Å²	121.7	85%	0.847	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-70.1	118.3	166.5	-73.1	-81.3	96.8	0	0	107.7	T458	M456-T458 PolarHBondContact O-N 3.3Å
457	L	57.5	Low	57	Low	91 Å²	91	118.6 Å²	118.6	48%	0.476	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-53.6	132.6	172.7	-72.1	169.2	0	0	0	109.7	L455 E461 K462	L455-L457 PolarHBondContact O-N 3.33Å; L457-E461 HydrophobicContact CD2-CB 4.45Å; L457-K462 HydrophobicContact CB-CG 4.36Å; L457-K462 WeakPolarHBondContact O-CE 3.41Å; L457-K462 PolarHBondContact O-NZ 3.1Å
458	T	74.1	Confident	58.9	Low	77 Å²	77	116.2 Å²	116.2	47%	0.472	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-69.2	152.6	176.7	63.2	0	0	0	0	110	M456 E460 E461 K462	M456-T458 PolarHBondContact O-N 3.3Å; T458-E460 PolarHBondContact O-N 3.35Å; T458-E461 WeakPolarHBondContact CB-OE2 3.35Å; T458-E461 PolarHBondContact N-OE2 3.26Å; T458-E461 WeakPolarHBondContact O-CB 3.49Å; T458-E461 PolarHBondContact O-N 3.44Å; T458-E461 WeakPolarHBondContact OG1-CG 3.33Å; T458-E461 PolarHBondContact OG1-OE2 2.98Å; T458-K462 PolarHBondContact O-N 3.07Å; T458-K462 VanDerWaalsContact O-N 3.12Å
459	D	68.6	Low	60.7	Low	119 Å²	119	113.8 Å²	113.8	64%	0.636	61%	0.614	S	S	*	*	H	α-helix	trans	-65.6	-24	-177.9	-61.2	-45.9	0	0	0	112.3	K462 A463	D459-K462 PolarHBondContact O-N 3Å; D459-K462 WeakPolarHBondContact OD1-CD 3.24Å; D459-K462 IonicContact OD1-NZ 2.65Å; D459-K462 PolarHBondContact OD1-NZ 3.06Å; D459-A463 VanDerWaalsContact O-CB 3.28Å; D459-A463 WeakPolarHBondContact O-CB 3.29Å; D459-A463 PolarHBondContact O-N 3.33Å
460	E	71.4	Confident	62.6	Low	122 Å²	122	110.4 Å²	110.4	57%	0.57	60%	0.598	S	S	*	*	H	α-helix	trans	-66.5	-31.6	170.6	-171.3	70.8	-141.2	0	0	113.2	T458 R464	T458-E460 PolarHBondContact O-N 3.35Å; E460-R464 VanDerWaalsContact CG-NH2 3.26Å; E460-R464 WeakPolarHBondContact O-CG 3.45Å; E460-R464 PolarHBondContact O-N 2.84Å; E460-R464 PolarHBondContact O-NE 3.18Å; E460-R464 VanDerWaalsContact O-NE 3.11Å
461	E	71.1	Confident	64.7	Low	79 Å²	79	109.9 Å²	109.9	37%	0.369	59%	0.591	S	S	.	*	H	α-helix	trans	-78	-41.3	173.2	-70.1	163.9	114.9	0	0	110.9	L457 T458 A463 R464 I465	L457-E461 HydrophobicContact CD2-CB 4.45Å; T458-E461 WeakPolarHBondContact CB-OE2 3.35Å; T458-E461 PolarHBondContact N-OE2 3.26Å; T458-E461 WeakPolarHBondContact O-CB 3.49Å; T458-E461 PolarHBondContact O-N 3.44Å; T458-E461 WeakPolarHBondContact OG1-CG 3.33Å; T458-E461 PolarHBondContact OG1-OE2 2.98Å; E461-A463 VanDerWaalsContact C-N 3.34Å; E461-A463 PolarHBondContact O-N 3.03Å; E461-R464 PolarHBondContact O-N 2.85Å; E461-I465 WeakPolarHBondContact O-CG1 3.4Å; E461-I465 PolarHBondContact O-N 2.79Å
462	K	74.8	Confident	66.6	Low	81 Å²	81	106.5 Å²	106.5	35%	0.352	58%	0.58	S	S	.	*	H	α-helix	trans	-59.8	-45.2	174	-61.8	171.7	-161.1	146.8	0	111	L457 T458 D459 R464 I465 H466	L457-K462 HydrophobicContact CB-CG 4.36Å; L457-K462 WeakPolarHBondContact O-CE 3.41Å; L457-K462 PolarHBondContact O-NZ 3.1Å; T458-K462 PolarHBondContact O-N 3.07Å; T458-K462 VanDerWaalsContact O-N 3.12Å; D459-K462 PolarHBondContact O-N 3Å; D459-K462 WeakPolarHBondContact OD1-CD 3.24Å; D459-K462 IonicContact OD1-NZ 2.65Å; D459-K462 PolarHBondContact OD1-NZ 3.06Å; K462-R464 VanDerWaalsContact C-N 3.32Å; K462-R464 PolarHBondContact O-N 3.49Å; K462-I465 PolarHBondContact O-N 3.2Å; K462-H466 PolarHBondContact O-CD2 3.09Å; K462-H466 PolarHBondContact O-N 2.95Å
463	A	75.3	Confident	68.4	Low	56 Å²	56	108.2 Å²	108.2	46%	0.463	58%	0.579	S	S	.	*	H	α-helix	trans	-58	-43.2	177	0	0	0	0	0	112	D459 E461 H466 A467	D459-A463 VanDerWaalsContact O-CB 3.28Å; D459-A463 WeakPolarHBondContact O-CB 3.29Å; D459-A463 PolarHBondContact O-N 3.33Å; E461-A463 VanDerWaalsContact C-N 3.34Å; E461-A463 PolarHBondContact O-N 3.03Å; A463-H466 PolarHBondContact O-N 3.38Å; A463-A467 WeakPolarHBondContact O-CB 3.42Å; A463-A467 PolarHBondContact O-N 2.85Å
464	R	77.2	Confident	70	Confident	151 Å²	151	107.5 Å²	107.5	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-66.1	-44.6	176.9	-78.2	-177.3	-88.2	-159.8	3.7	112.8	E460 E461 K462 H466 A467 E468	E460-R464 VanDerWaalsContact CG-NH2 3.26Å; E460-R464 WeakPolarHBondContact O-CG 3.45Å; E460-R464 PolarHBondContact O-N 2.84Å; E460-R464 PolarHBondContact O-NE 3.18Å; E460-R464 VanDerWaalsContact O-NE 3.11Å; E461-R464 PolarHBondContact O-N 2.85Å; K462-R464 VanDerWaalsContact C-N 3.32Å; K462-R464 PolarHBondContact O-N 3.49Å; R464-H466 VanDerWaalsContact C-N 3.33Å; R464-H466 PolarHBondContact O-N 3.02Å; R464-A467 PolarHBondContact O-N 3.49Å; R464-E468 WeakPolarHBondContact O-CB 3.35Å; R464-E468 PolarHBondContact O-N 2.93Å
465	I	78.3	Confident	71.5	Confident	87 Å²	87	106.7 Å²	106.7	45%	0.446	55%	0.55	S	S	.	.	H	α-helix	trans	-61.4	-41.3	176.1	-66.5	163.8	0	0	0	111.1	E461 K462 T469	E461-I465 WeakPolarHBondContact O-CG1 3.4Å; E461-I465 PolarHBondContact O-N 2.79Å; K462-I465 PolarHBondContact O-N 3.2Å; I465-T469 WeakPolarHBondContact O-CB 3.3Å; I465-T469 PolarHBondContact O-N 2.92Å; I465-T469 PolarHBondContact O-OG1 2.87Å
466	H	74.6	Confident	72.6	Confident	138 Å²	138	104.3 Å²	104.3	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-67.1	-39.9	175.8	-78.6	-61	0	0	0	112.8	K462 A463 R464 T469 A470	K462-H466 PolarHBondContact O-CD2 3.09Å; K462-H466 PolarHBondContact O-N 2.95Å; A463-H466 PolarHBondContact O-N 3.38Å; R464-H466 VanDerWaalsContact C-N 3.33Å; R464-H466 PolarHBondContact O-N 3.02Å; H466-T469 PolarHBondContact O-N 3.36Å; H466-A470 WeakPolarHBondContact O-CB 3.26Å; H466-A470 PolarHBondContact O-N 2.83Å
467	A	77.8	Confident	73.6	Confident	60 Å²	60	104.2 Å²	104.2	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-45.8	175.8	0	0	0	0	0	112.1	A463 R464 T469 A470 L471	A463-A467 WeakPolarHBondContact O-CB 3.42Å; A463-A467 PolarHBondContact O-N 2.85Å; R464-A467 PolarHBondContact O-N 3.49Å; A467-T469 PolarHBondContact O-N 2.99Å; A467-A470 PolarHBondContact O-N 2.86Å; A467-L471 PolarHBondContact O-N 2.69Å
468	E	77.8	Confident	73.9	Confident	144 Å²	144	106.9 Å²	106.9	67%	0.673	54%	0.543	S	S	*	.	H	α-helix	trans	-62.2	-42.6	176.7	-174	172.2	-162.4	0	0	111.8	R464 A470 L471 L472	R464-E468 WeakPolarHBondContact O-CB 3.35Å; R464-E468 PolarHBondContact O-N 2.93Å; E468-A470 PolarHBondContact O-N 2.74Å; E468-L471 PolarHBondContact O-N 2.97Å; E468-L472 WeakPolarHBondContact O-CB 3.34Å; E468-L472 PolarHBondContact O-N 3.03Å
469	T	76.5	Confident	73.1	Confident	68 Å²	68	109.5 Å²	109.5	42%	0.417	55%	0.55	S	S	.	.	H	α-helix	trans	-63.2	-40.1	176.2	-56.3	0	0	0	0	112.1	I465 H466 A467 L472 M473	I465-T469 WeakPolarHBondContact O-CB 3.3Å; I465-T469 PolarHBondContact O-N 2.92Å; I465-T469 PolarHBondContact O-OG1 2.87Å; H466-T469 PolarHBondContact O-N 3.36Å; A467-T469 PolarHBondContact O-N 2.99Å; T469-L472 PolarHBondContact O-N 3.01Å; T469-M473 PolarHBondContact O-N 3.22Å; T469-M473 VanDerWaalsContact O-N 3.15Å
470	A	79.6	Confident	71.9	Confident	53 Å²	53	115.6 Å²	115.6	44%	0.438	57%	0.571	S	S	.	*	H	α-helix	trans	-64.8	-45.1	176.4	0	0	0	0	0	111.7	H466 A467 E468 L472 M473 E474	H466-A470 WeakPolarHBondContact O-CB 3.26Å; H466-A470 PolarHBondContact O-N 2.83Å; A467-A470 PolarHBondContact O-N 2.86Å; E468-A470 PolarHBondContact O-N 2.74Å; A470-L472 VanDerWaalsContact C-N 3.32Å; A470-L472 PolarHBondContact O-N 3.45Å; A470-M473 PolarHBondContact O-N 2.82Å; A470-E474 PolarHBondContact O-N 2.95Å
471	L	77.9	Confident	71.9	Confident	124 Å²	124	115.3 Å²	115.3	65%	0.649	57%	0.571	S	S	*	*	H	α-helix	trans	-62	-38.7	178.4	-133.9	166.9	0	0	0	111.7	A467 E468 E474 K475	A467-L471 PolarHBondContact O-N 2.69Å; E468-L471 PolarHBondContact O-N 2.97Å; L471-E474 PolarHBondContact O-N 3.06Å; L471-K475 WeakPolarHBondContact O-CB 3.35Å; L471-K475 PolarHBondContact O-N 2.9Å
472	L	75.4	Confident	72	Confident	109 Å²	109	117.2 Å²	117.2	57%	0.571	58%	0.581	S	S	*	*	H	α-helix	trans	-66.3	-37.3	175.7	-173.5	63.9	0	0	0	112.8	E468 T469 A470 N476	E468-L472 WeakPolarHBondContact O-CB 3.34Å; E468-L472 PolarHBondContact O-N 3.03Å; T469-L472 PolarHBondContact O-N 3.01Å; A470-L472 VanDerWaalsContact C-N 3.32Å; A470-L472 PolarHBondContact O-N 3.45Å; L472-N476 PolarHBondContact O-N 3.02Å; L472-N476 VanDerWaalsContact O-N 3.16Å; L472-N476 PolarHBondContact O-ND2 3.18Å
473	M	71.6	Confident	71.8	Confident	130 Å²	130	119.2 Å²	119.2	64%	0.64	59%	0.594	S	S	*	*	H	α-helix	trans	-73.9	-36.1	175.2	-73	-159.9	-67.4	0	0	112.8	T469 A470 N476 K477	T469-M473 PolarHBondContact O-N 3.22Å; T469-M473 VanDerWaalsContact O-N 3.15Å; A470-M473 PolarHBondContact O-N 2.82Å; M473-N476 PolarHBondContact O-N 3.26Å; M473-K477 PolarHBondContact O-N 3.34Å
474	E	73.7	Confident	71.6	Confident	119 Å²	119	122.9 Å²	122.9	56%	0.556	60%	0.602	S	S	*	*	H	α-helix	trans	-66.7	-40.3	174.7	-175.7	153.2	-139.5	0	0	111.5	A470 L471 N476 K477 Q478	A470-E474 PolarHBondContact O-N 2.95Å; L471-E474 PolarHBondContact O-N 3.06Å; E474-N476 PolarHBondContact O-N 3.31Å; E474-K477 WeakPolarHBondContact O-CB 3.4Å; E474-K477 PolarHBondContact O-N 2.9Å; E474-Q478 PolarHBondContact O-N 3.36Å
475	K	76.1	Confident	71.3	Confident	110 Å²	110	121.2 Å²	121.2	48%	0.478	60%	0.604	S	S	.	*	H	α-helix	trans	-59.3	-46.7	171.9	-176	176	173.6	-178.7	0	112.3	L471 K477 Q478 E479	L471-K475 WeakPolarHBondContact O-CB 3.35Å; L471-K475 PolarHBondContact O-N 2.9Å; K475-K477 PolarHBondContact O-N 3.23Å; K475-K477 VanDerWaalsContact O-N 3.08Å; K475-Q478 PolarHBondContact O-N 3.16Å; K475-E479 WeakPolarHBondContact CE-OE1 3.14Å; K475-E479 IonicContact NZ-OE1 3.88Å; K475-E479 PolarHBondContact NZ-OE1 2.56Å; K475-E479 PolarHBondContact O-N 3.06Å
476	N	65.6	Low	70.8	Confident	101 Å²	101	123.5 Å²	123.5	54%	0.54	61%	0.614	S	S	.	*	H	α-helix	trans	-61.2	-16.6	175.4	-89.2	-91.4	0	0	0	113.9	L472 M473 E474	L472-N476 PolarHBondContact O-N 3.02Å; L472-N476 VanDerWaalsContact O-N 3.16Å; L472-N476 PolarHBondContact O-ND2 3.18Å; M473-N476 PolarHBondContact O-N 3.26Å; E474-N476 PolarHBondContact O-N 3.31Å
477	K	70.1	Confident	70.5	Confident	170 Å²	170	122.4 Å²	122.4	74%	0.739	61%	0.613	S	S	*	*	H	α-helix	trans	-91.3	-15.4	176.3	-165.8	-175.8	173.1	-168.1	0	113	M473 E474 K475	M473-K477 PolarHBondContact O-N 3.34Å; E474-K477 WeakPolarHBondContact O-CB 3.4Å; E474-K477 PolarHBondContact O-N 2.9Å; K475-K477 PolarHBondContact O-N 3.23Å; K475-K477 VanDerWaalsContact O-N 3.08Å
478	Q	64.7	Low	70	Confident	146 Å²	146	127.2 Å²	127.2	68%	0.682	62%	0.622	S	S	*	*	H	α-helix	trans	-97.3	-13.8	176	-66.5	177.8	-1	0	0	112.9	E474 K475 K480	E474-Q478 PolarHBondContact O-N 3.36Å; K475-Q478 PolarHBondContact O-N 3.16Å; Q478-K480 VanDerWaalsContact C-N 3.31Å
479	E	56.9	Low	69.3	Low	133 Å²	133	125.8 Å²	125.8	62%	0.621	62%	0.617	S	S	*	*			trans	-95.4	29.9	174.9	-65.1	178.2	166.1	0	0	112.1	K475	K475-E479 WeakPolarHBondContact CE-OE1 3.14Å; K475-E479 IonicContact NZ-OE1 3.88Å; K475-E479 PolarHBondContact NZ-OE1 2.56Å; K475-E479 PolarHBondContact O-N 3.06Å
480	K	44	Very low	68.7	Low	247 Å²	247	131.1 Å²	131.1	100%	1.074	64%	0.635	S	S	*	*			trans	-140.8	0	174	-83.5	-166.9	174.7	-174	0	111.7	Q478	Q478-K480 VanDerWaalsContact C-N 3.31Å

Retrieved 480 of 480 residues in 175.8 ms (Link to these results)

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