X5LV96_CAEEL Loading...

Tubby C-terminal domain-containing protein

AlphaFold DB , UniProt , Accession X5LV96, Species CAEEL (Caenorhabditis elegans), Gene tub-2, Length 329 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	57.6	Low	53.5	Low	98 Å²	98	84.7 Å²	84.7	48%	0.483	43%	0.426	S	S	.	.				0	136.8	0	-175	176.3	-175	0	0	107.7	I3 N255 V319	M1-I3 HydrophobicContact CE-CD1 3.92Å; M1-I3 HydrophobicContact CE-CG1 4.05Å; M1-I3 HydrophobicContact CG-CG1 4.25Å; M1-I3 HydrophobicContact SD-CD1 4.41Å; M1-N255 HydrophobicContact CB-CB 4.35Å; M1-N255 PolarHBondContact O-N 3.39Å; M1-V319 HydrophobicContact CE-CG1 4.2Å
2	T	60.7	Low	52.8	Low	93 Å²	93	88.5 Å²	88.5	57%	0.571	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.5	175.2	-51	0	0	0	0	106.9	T252 M253 T254	T2-T252 HydrophobicContact CG2-CG2 3.87Å; T2-M253 WeakPolarHBondContact CA-O 3.41Å; T2-M253 WeakPolarHBondContact CG2-O 3.29Å; T2-T254 HydrophobicContact CG2-CG2 4.42Å
3	I	68.6	Low	51.7	Low	20 Å²	20	87.6 Å²	87.6	10%	0.103	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	115.2	-175.3	-54	175.4	0	0	0	107.8	M1 M253 I285 V319	M1-I3 HydrophobicContact CE-CD1 3.92Å; M1-I3 HydrophobicContact CE-CG1 4.05Å; M1-I3 HydrophobicContact CG-CG1 4.25Å; M1-I3 HydrophobicContact SD-CD1 4.41Å; I3-M253 HydrophobicContact CB-CB 4.46Å; I3-M253 PolarHBondContact N-O 3.47Å; I3-M253 PolarHBondContact O-N 3.34Å; I3-I285 HydrophobicContact CD1-CD1 3.66Å; I3-I285 HydrophobicContact CD1-CG1 3.88Å; I3-I285 HydrophobicContact CD1-CG2 4.44Å; I3-V319 HydrophobicContact CD1-CB 4.46Å; I3-V319 HydrophobicContact CD1-CG1 3.6Å; I3-V319 HydrophobicContact CD1-CG2 3.94Å; I3-V319 HydrophobicContact CG2-CG2 4.43Å
4	D	63.6	Low	50	Low	105 Å²	105	96.3 Å²	96.3	56%	0.561	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	111.6	171.6	-66.3	-54.9	0	0	0	109.3	I250 T252	D4-I250 HydrophobicContact CB-CG2 3.93Å; D4-T252 WeakPolarHBondContact OD1-CA 3.43Å; D4-T252 VanDerWaalsContact OD1-CB 3.26Å; D4-T252 WeakPolarHBondContact OD1-CB 3.32Å; D4-T252 VanDerWaalsContact OD1-CG2 3.29Å; D4-T252 WeakPolarHBondContact OD1-CG2 3.48Å; D4-T252 PolarHBondContact OD1-OG1 3.15Å
5	L	60.3	Low	48.9	Very low	17 Å²	17	101.6 Å²	101.6	9%	0.089	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.2	179.8	-162.6	69.8	0	0	0	110.5	V7 I250 E251 M253 P310 F311 Q315	L5-V7 HydrophobicContact CB-CG2 4.22Å; L5-V7 HydrophobicContact CD2-CG2 3.96Å; L5-V7 HydrophobicContact CG-CG2 4.08Å; L5-V7 PolarHBondContact O-N 3.43Å; L5-V7 VanDerWaalsContact O-N 3.16Å; L5-I250 WeakPolarHBondContact O-CA 3.37Å; L5-E251 PolarHBondContact N-O 3.16Å; L5-E251 PolarHBondContact O-N 3.44Å; L5-M253 HydrophobicContact CD2-CE 4.12Å; L5-P310 HydrophobicContact CD2-CB 4.26Å; L5-P310 HydrophobicContact CD2-CG 3.9Å; L5-F311 HydrophobicContact CD1-CD1 4.46Å; L5-F311 HydrophobicContact CD1-CE1 4.23Å; L5-F311 HydrophobicContact CD2-CD1 3.94Å; L5-F311 HydrophobicContact CD2-CE1 4.03Å; L5-F311 HydrophobicContact CD2-CG 4.44Å; L5-Q315 HydrophobicContact CD1-CG 4.36Å
6	A	57.5	Low	47.8	Very low	63 Å²	63	105.3 Å²	105.3	52%	0.521	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	101	171.2	0	0	0	0	0	109.7
7	V	55.7	Low	47.3	Very low	9 Å²	9	105.7 Å²	105.7	6%	0.055	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.1	112.2	-176.3	-178.5	0	0	0	0	110	L5 Q9 K249 E251 Y309 P310	L5-V7 HydrophobicContact CB-CG2 4.22Å; L5-V7 HydrophobicContact CD2-CG2 3.96Å; L5-V7 HydrophobicContact CG-CG2 4.08Å; L5-V7 PolarHBondContact O-N 3.43Å; L5-V7 VanDerWaalsContact O-N 3.16Å; V7-Q9 VanDerWaalsContact C-N 3.27Å; V7-Q9 HydrophobicContact CG1-CG 4.05Å; V7-Q9 PolarHBondContact O-N 3.39Å; V7-K249 PolarHBondContact N-O 3.47Å; V7-K249 PolarHBondContact O-N 2.99Å; V7-E251 HydrophobicContact CB-CG 4.08Å; V7-E251 HydrophobicContact CG2-CB 3.92Å; V7-E251 HydrophobicContact CG2-CG 3.9Å; V7-E251 WeakPolarHBondContact CG2-OE2 3.29Å; V7-Y309 WeakPolarHBondContact CG1-OH 3.29Å; V7-P310 HydrophobicContact CB-CB 4.46Å; V7-P310 HydrophobicContact CG1-CB 3.87Å; V7-P310 HydrophobicContact CG2-CB 3.66Å; V7-P310 HydrophobicContact CG2-CG 3.92Å
8	L	45.6	Very low	46.8	Very low	136 Å²	136	110.3 Å²	110.3	71%	0.712	58%	0.575	S	S	*	*			trans	-79	74.6	179.5	-158.4	86	0	0	0	110.4	R10	L8-R10 PolarHBondContact O-N 2.79Å; L8-R10 VanDerWaalsContact O-N 3.13Å
9	Q	45.4	Very low	45.9	Very low	73 Å²	73	109.8 Å²	109.8	34%	0.341	59%	0.589	S	S	.	*			trans	-62.2	116.3	175.7	-65.2	-159	-1.4	0	0	110.2	V7 K11 E251	V7-Q9 VanDerWaalsContact C-N 3.27Å; V7-Q9 HydrophobicContact CG1-CG 4.05Å; V7-Q9 PolarHBondContact O-N 3.39Å; Q9-K11 PolarHBondContact O-N 3.2Å; Q9-E251 PolarHBondContact NE2-OE1 3.47Å
10	R	38.8	Very low	45.1	Very low	238 Å²	238	110.2 Å²	110.2	90%	0.898	60%	0.601	S	S	*	*			trans	-68.6	108.5	165.7	-78.9	-174.1	-80.3	179.6	-6.3	107.5	L8	L8-R10 PolarHBondContact O-N 2.79Å; L8-R10 VanDerWaalsContact O-N 3.13Å
11	K	34.8	Very low	44.8	Very low	80 Å²	80	112 Å²	112	35%	0.348	62%	0.615	S	S	.	*			trans	-67.8	134.5	175.8	-108.4	-168	-173.7	147.6	0	111.6	Q9 N245	Q9-K11 PolarHBondContact O-N 3.2Å; K11-N245 HydrophobicContact CB-CB 4.36Å; K11-N245 HydrophobicContact CD-CB 3.66Å; K11-N245 VanDerWaalsContact CD-O 3.27Å; K11-N245 WeakPolarHBondContact CD-O 3.41Å; K11-N245 WeakPolarHBondContact CD-OD1 3.26Å; K11-N245 WeakPolarHBondContact CE-O 3.45Å; K11-N245 PolarHBondContact NZ-O 3.46Å; K11-N245 PolarHBondContact NZ-OD1 3.24Å
12	D	44.8	Very low	43.5	Very low	130 Å²	130	114.8 Å²	114.8	70%	0.695	63%	0.632	S	S	*	*			trans	45.5	119.3	146.5	-38	-30.2	0	0	0	117.8
13	G	38.2	Very low	42	Very low	77 Å²	77	113.3 Å²	113.3	79%	0.794	64%	0.635	S	S	*	*			cis	168.3	136.1	-3.2	0	0	0	0	0	110.5
14	K	28.8	Very low	40.5	Very low	209 Å²	209	118.3 Å²	118.3	91%	0.909	67%	0.667	S	S	*	*			trans	-156.4	111.9	169.5	-149.1	179.2	-174.1	-173.9	0	109.9
15	E	33.2	Very low	39	Very low	176 Å²	176	119.5 Å²	119.5	82%	0.822	68%	0.677	S	S	*	*			trans	-81.3	179	167.2	-68.8	-169.5	115.9	0	0	111.2
16	L	31.3	Very low	37.7	Very low	161 Å²	161	127 Å²	127	84%	0.843	71%	0.712	S	S	*	*			trans	80.1	144	177.9	-70.9	84.6	0	0	0	117.5
17	P	38.4	Very low	36.3	Very low	112 Å²	112	132.2 Å²	132.2	73%	0.727	73%	0.728	S	S	*	*			cis	-118.4	167.7	-16	34.5	-19	0	0	0	113.3	A19	P17-A19 PolarHBondContact O-N 3.28Å
18	E	39.2	Very low	35	Very low	188 Å²	188	138.3 Å²	138.3	88%	0.879	77%	0.765	S	S	*	*			trans	-62.9	127.8	158.3	-65.6	-172.4	130	0	0	109.1
19	A	29.1	Very low	34.5	Very low	102 Å²	102	137.2 Å²	137.2	84%	0.843	77%	0.768	S	S	*	*			trans	-88.1	108.9	172.3	0	0	0	0	0	109.2	P17	P17-A19 PolarHBondContact O-N 3.28Å
20	S	29.9	Very low	33.7	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	79%	0.788	S	S	*	*			trans	-66	165.2	174.2	-48.1	0	0	0	0	112.1
21	V	39.9	Very low	34.2	Very low	148 Å²	148	133.6 Å²	133.6	90%	0.897	79%	0.785	S	S	*	*	S	Bend	trans	-70.1	143.9	-174.5	-176.4	0	0	0	0	112.8
22	D	30.4	Very low	34.6	Very low	157 Å²	157	134.7 Å²	134.7	84%	0.84	79%	0.794	S	S	*	*			trans	109.5	146.1	153.4	-145.3	-1.1	0	0	0	117.2
23	G	28.9	Very low	35	Very low	62 Å²	62	137.8 Å²	137.8	64%	0.639	81%	0.805	S	S	*	*			trans	127.1	81.1	-178.8	0	0	0	0	0	114.7	T25	G23-T25 PolarHBondContact O-N 2.86Å
24	T	37	Very low	35.5	Very low	125 Å²	125	137.4 Å²	137.4	77%	0.767	80%	0.8	S	S	*	*			trans	-61.8	130.5	172.2	-64	0	0	0	0	112.3
25	T	30.6	Very low	36.3	Very low	129 Å²	129	130.8 Å²	130.8	79%	0.791	78%	0.775	S	S	*	*			trans	-144.7	124.6	154.3	-1.3	0	0	0	0	111	G23 M27	G23-T25 PolarHBondContact O-N 2.86Å; T25-M27 PolarHBondContact O-N 2.74Å
26	H	33.5	Very low	37.7	Very low	175 Å²	175	126.2 Å²	126.2	81%	0.81	76%	0.759	S	S	*	*			trans	-71.5	125.1	174.5	-109	-108.1	0	0	0	110.3
27	M	28.5	Very low	38.6	Very low	173 Å²	173	123.4 Å²	123.4	85%	0.852	75%	0.753	S	S	*	*			trans	-127.9	139.5	157	-77.3	-65.6	153.3	0	0	109	T25	T25-M27 PolarHBondContact O-N 2.74Å
28	T	29.4	Very low	39	Very low	136 Å²	136	125.8 Å²	125.8	83%	0.834	75%	0.754	S	S	*	*			trans	-72.8	131.7	-160.8	47.5	0	0	0	0	113.6
29	S	33.8	Very low	39.3	Very low	113 Å²	113	120.4 Å²	120.4	79%	0.79	73%	0.729	S	S	*	*			trans	-70	126.5	179.8	53.9	0	0	0	0	113.7
30	S	30	Very low	40.4	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	71%	0.707	S	S	*	*			trans	-105.9	104.8	164.8	46.5	0	0	0	0	110.3	D32	S30-D32 PolarHBondContact O-N 3.18Å
31	P	47.4	Very low	41.4	Very low	129 Å²	129	121.6 Å²	121.6	84%	0.838	70%	0.7	S	S	*	*			trans	-95.7	62.3	-163	37.9	-37.7	0	0	0	114.8
32	D	44	Very low	41.9	Very low	103 Å²	103	120 Å²	120	55%	0.551	68%	0.681	S	S	*	*			trans	-150.6	61.8	163	-164	5.7	0	0	0	113.6	S30 R40	S30-D32 PolarHBondContact O-N 3.18Å; D32-R40 VanDerWaalsContact CG-NH2 3.33Å; D32-R40 IonicContact OD1-CZ 3.24Å; D32-R40 IonicContact OD1-NH1 3.5Å; D32-R40 IonicContact OD1-NH2 3.48Å; D32-R40 PolarHBondContact OD1-NH2 3.37Å; D32-R40 IonicContact OD2-CZ 2.71Å; D32-R40 IonicContact OD2-NH1 2.74Å; D32-R40 PolarHBondContact OD2-NH1 3.33Å; D32-R40 IonicContact OD2-NH2 2.69Å; D32-R40 PolarHBondContact OD2-NH2 3.23Å
33	Q	53.3	Low	42.9	Very low	196 Å²	196	115.8 Å²	115.8	92%	0.916	66%	0.655	S	S	*	*			trans	-121.3	63.4	166.1	-75.4	-164.8	-16.4	0	0	111.5
34	G	49.4	Very low	44.2	Very low	68 Å²	68	119.4 Å²	119.4	70%	0.701	66%	0.655	S	S	*	*	S	Bend	trans	-95.2	-33.8	166	0	0	0	0	0	113.9
35	L	45.3	Very low	44.8	Very low	70 Å²	70	119.8 Å²	119.8	37%	0.366	65%	0.647	S	S	.	*	S	Bend	trans	-150.4	134.2	-174.4	-72.1	167.7	0	0	0	109.5	E39 R40 F43	L35-E39 HydrophobicContact CB-CB 4.42Å; L35-E39 HydrophobicContact CD2-CB 3.95Å; L35-R40 HydrophobicContact CB-CB 4.49Å; L35-R40 PolarHBondContact O-NH2 3.48Å; L35-F43 HydrophobicContact CD1-CD2 4.16Å; L35-F43 HydrophobicContact CD2-CD2 4Å; L35-F43 HydrophobicContact CD2-CE2 3.68Å
36	T	63.1	Low	45.9	Very low	81 Å²	81	116.2 Å²	116.2	50%	0.497	62%	0.622	S	S	.	*			trans	-64.9	165.5	170.6	63.4	0	0	0	0	111.6	E38 E39 R40	T36-E38 VanDerWaalsContact C-N 3.28Å; T36-E38 PolarHBondContact O-N 3.42Å; T36-E39 VanDerWaalsContact CB-OE2 3.3Å; T36-E39 WeakPolarHBondContact CB-OE2 3.29Å; T36-E39 WeakPolarHBondContact CG2-OE2 3.11Å; T36-E39 PolarHBondContact N-OE2 2.86Å; T36-E39 PolarHBondContact O-N 3.18Å; T36-E39 VanDerWaalsContact OG1-CD 3.28Å; T36-E39 VanDerWaalsContact OG1-CG 3.28Å; T36-E39 WeakPolarHBondContact OG1-CG 3.19Å; T36-E39 PolarHBondContact OG1-N 3.18Å; T36-E39 PolarHBondContact OG1-OE2 2.69Å; T36-R40 VanDerWaalsContact O-CB 3.32Å; T36-R40 WeakPolarHBondContact O-CB 3.47Å; T36-R40 PolarHBondContact O-N 2.85Å
37	S	49.1	Very low	46.8	Very low	101 Å²	101	113.2 Å²	113.2	71%	0.706	61%	0.611	S	S	*	*	H	α-helix	trans	-59.7	-39.1	178.9	-166.3	0	0	0	0	112.5	R40 Q41	S37-R40 PolarHBondContact O-N 3.28Å; S37-Q41 WeakPolarHBondContact O-CB 3.38Å; S37-Q41 PolarHBondContact O-N 2.82Å
38	E	46.1	Very low	48	Very low	162 Å²	162	107.8 Å²	107.8	76%	0.757	59%	0.594	S	S	*	*	H	α-helix	trans	-67.9	-44.5	179.4	-62.1	-179.5	177.2	0	0	111.4	T36 Q41 F42	T36-E38 VanDerWaalsContact C-N 3.28Å; T36-E38 PolarHBondContact O-N 3.42Å; E38-Q41 PolarHBondContact O-N 3.2Å; E38-F42 WeakPolarHBondContact O-CB 3.13Å; E38-F42 PolarHBondContact O-N 2.82Å
39	E	46.3	Very low	48.8	Very low	75 Å²	75	106.4 Å²	106.4	35%	0.35	58%	0.578	S	S	.	*	H	α-helix	trans	-64.2	-43.4	174.2	-66.7	164.5	127.9	0	0	111.4	L35 T36 Q41 F42 F43	L35-E39 HydrophobicContact CB-CB 4.42Å; L35-E39 HydrophobicContact CD2-CB 3.95Å; T36-E39 VanDerWaalsContact CB-OE2 3.3Å; T36-E39 WeakPolarHBondContact CB-OE2 3.29Å; T36-E39 WeakPolarHBondContact CG2-OE2 3.11Å; T36-E39 PolarHBondContact N-OE2 2.86Å; T36-E39 PolarHBondContact O-N 3.18Å; T36-E39 VanDerWaalsContact OG1-CD 3.28Å; T36-E39 VanDerWaalsContact OG1-CG 3.28Å; T36-E39 WeakPolarHBondContact OG1-CG 3.19Å; T36-E39 PolarHBondContact OG1-N 3.18Å; T36-E39 PolarHBondContact OG1-OE2 2.69Å; E39-Q41 VanDerWaalsContact C-N 3.28Å; E39-Q41 PolarHBondContact O-N 3.13Å; E39-F42 WeakPolarHBondContact O-CB 3.4Å; E39-F42 PolarHBondContact O-N 2.91Å; E39-F43 HydrophobicContact CB-CD2 4.47Å; E39-F43 HydrophobicContact CB-CE2 4.42Å; E39-F43 WeakPolarHBondContact O-CD2 3.47Å; E39-F43 PolarHBondContact O-N 2.89Å
40	R	52.3	Low	49.3	Very low	104 Å²	104	104.6 Å²	104.6	39%	0.392	56%	0.564	S	S	.	*	H	α-helix	trans	-62.4	-36.5	178.6	-159.8	175.6	-61.7	-154.5	1.2	111.3	D32 L35 T36 S37 Q44	D32-R40 VanDerWaalsContact CG-NH2 3.33Å; D32-R40 IonicContact OD1-CZ 3.24Å; D32-R40 IonicContact OD1-NH1 3.5Å; D32-R40 IonicContact OD1-NH2 3.48Å; D32-R40 PolarHBondContact OD1-NH2 3.37Å; D32-R40 IonicContact OD2-CZ 2.71Å; D32-R40 IonicContact OD2-NH1 2.74Å; D32-R40 PolarHBondContact OD2-NH1 3.33Å; D32-R40 IonicContact OD2-NH2 2.69Å; D32-R40 PolarHBondContact OD2-NH2 3.23Å; L35-R40 HydrophobicContact CB-CB 4.49Å; L35-R40 PolarHBondContact O-NH2 3.48Å; T36-R40 VanDerWaalsContact O-CB 3.32Å; T36-R40 WeakPolarHBondContact O-CB 3.47Å; T36-R40 PolarHBondContact O-N 2.85Å; S37-R40 PolarHBondContact O-N 3.28Å; R40-Q44 PolarHBondContact O-N 2.99Å; R40-Q44 VanDerWaalsContact O-N 3.16Å
41	Q	50.3	Low	50.6	Low	140 Å²	140	104.8 Å²	104.8	65%	0.654	56%	0.557	S	S	*	*	H	α-helix	trans	-74.1	-36.9	174.8	-166.8	173.1	71.3	0	0	112.7	S37 E38 E39 Q44 K45	S37-Q41 WeakPolarHBondContact O-CB 3.38Å; S37-Q41 PolarHBondContact O-N 2.82Å; E38-Q41 PolarHBondContact O-N 3.2Å; E39-Q41 VanDerWaalsContact C-N 3.28Å; E39-Q41 PolarHBondContact O-N 3.13Å; Q41-Q44 PolarHBondContact O-N 2.95Å; Q41-K45 PolarHBondContact O-N 2.81Å
42	F	50.2	Low	50.8	Low	115 Å²	115	102.1 Å²	102.1	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-61.9	-48.1	172.6	171.7	-100.4	0	0	0	112.1	E38 E39 Q44 K45 I46	E38-F42 WeakPolarHBondContact O-CB 3.13Å; E38-F42 PolarHBondContact O-N 2.82Å; E39-F42 WeakPolarHBondContact O-CB 3.4Å; E39-F42 PolarHBondContact O-N 2.91Å; F42-Q44 PolarHBondContact O-N 2.88Å; F42-K45 PolarHBondContact O-N 2.85Å; F42-K45 VanDerWaalsContact O-N 3.14Å; F42-I46 HydrophobicContact CD1-CD1 4.31Å; F42-I46 HydrophobicContact CE1-CD1 3.62Å; F42-I46 HydrophobicContact CE2-CD1 3.9Å; F42-I46 HydrophobicContact CZ-CD1 3.39Å; F42-I46 HydrophobicContact CZ-CG1 4.45Å; F42-I46 PolarHBondContact O-N 3.38Å
43	F	52	Low	50.9	Low	69 Å²	69	102.4 Å²	102.4	30%	0.303	54%	0.542	S	S	.	.	H	α-helix	trans	-65	-36.7	177.2	-75.7	-63.7	0	0	0	112.6	L35 E39 K45 L47 F317	L35-F43 HydrophobicContact CD1-CD2 4.16Å; L35-F43 HydrophobicContact CD2-CD2 4Å; L35-F43 HydrophobicContact CD2-CE2 3.68Å; E39-F43 HydrophobicContact CB-CD2 4.47Å; E39-F43 HydrophobicContact CB-CE2 4.42Å; E39-F43 WeakPolarHBondContact O-CD2 3.47Å; E39-F43 PolarHBondContact O-N 2.89Å; F43-K45 VanDerWaalsContact C-N 3.34Å; F43-K45 PolarHBondContact O-N 3.4Å; F43-L47 WeakPolarHBondContact O-CB 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.43Å; F43-L47 PolarHBondContact O-N 2.97Å; F43-F317 HydrophobicContact CE1-CE1 4.24Å; F43-F317 HydrophobicContact CE1-CZ 4.39Å
44	Q	57.1	Low	50.6	Low	137 Å²	137	101 Å²	101	64%	0.64	53%	0.528	S	S	*	.	H	α-helix	trans	-59.8	-42.5	170.2	-84.6	-168.1	-14.3	0	0	112.4	R40 Q41 F42 L47 A48	R40-Q44 PolarHBondContact O-N 2.99Å; R40-Q44 VanDerWaalsContact O-N 3.16Å; Q41-Q44 PolarHBondContact O-N 2.95Å; F42-Q44 PolarHBondContact O-N 2.88Å; Q44-L47 PolarHBondContact O-N 3.24Å; Q44-A48 PolarHBondContact O-N 2.98Å
45	K	49.2	Very low	50.8	Low	134 Å²	134	100.6 Å²	100.6	58%	0.583	52%	0.518	S	S	*	.	H	α-helix	trans	-66.8	-42.5	-179	-167.5	175.4	179.7	-176.9	0	112.4	Q41 F42 F43 A48 E49	Q41-K45 PolarHBondContact O-N 2.81Å; F42-K45 PolarHBondContact O-N 2.85Å; F42-K45 VanDerWaalsContact O-N 3.14Å; F43-K45 VanDerWaalsContact C-N 3.34Å; F43-K45 PolarHBondContact O-N 3.4Å; K45-A48 PolarHBondContact O-N 2.91Å; K45-E49 PolarHBondContact O-N 3.26Å
46	I	52.6	Low	51	Low	53 Å²	53	101.1 Å²	101.1	27%	0.272	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-43.3	174.2	-71.9	-176.9	0	0	0	111.1	F42 A48 E49 C50	F42-I46 HydrophobicContact CD1-CD1 4.31Å; F42-I46 HydrophobicContact CE1-CD1 3.62Å; F42-I46 HydrophobicContact CE2-CD1 3.9Å; F42-I46 HydrophobicContact CZ-CD1 3.39Å; F42-I46 HydrophobicContact CZ-CG1 4.45Å; F42-I46 PolarHBondContact O-N 3.38Å; I46-A48 VanDerWaalsContact C-N 3.32Å; I46-A48 PolarHBondContact O-N 2.91Å; I46-E49 PolarHBondContact O-N 2.86Å; I46-C50 WeakPolarHBondContact O-CB 3.4Å; I46-C50 PolarHBondContact O-N 2.71Å; I46-C50 PolarHBondContact O-SG 2.98Å
47	L	53.5	Low	50.1	Low	113 Å²	113	102.7 Å²	102.7	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-60	-41.4	175.6	-77.3	167.5	0	0	0	112.2	F43 Q44 L51	F43-L47 WeakPolarHBondContact O-CB 3.28Å; F43-L47 WeakPolarHBondContact O-CG 3.43Å; F43-L47 PolarHBondContact O-N 2.97Å; Q44-L47 PolarHBondContact O-N 3.24Å; L47-L51 WeakPolarHBondContact O-CB 3.43Å; L47-L51 VanDerWaalsContact O-CG 3.29Å; L47-L51 WeakPolarHBondContact O-CG 3.27Å; L47-L51 PolarHBondContact O-N 2.96Å
48	A	54.1	Low	50.4	Low	58 Å²	58	103.8 Å²	103.8	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-64.2	-44.9	176.8	0	0	0	0	0	112.6	Q44 K45 I46 L51 S52	Q44-A48 PolarHBondContact O-N 2.98Å; K45-A48 PolarHBondContact O-N 2.91Å; I46-A48 VanDerWaalsContact C-N 3.32Å; I46-A48 PolarHBondContact O-N 2.91Å; A48-L51 PolarHBondContact O-N 3.29Å; A48-S52 WeakPolarHBondContact O-CB 3.48Å; A48-S52 PolarHBondContact O-N 2.81Å
49	E	45.8	Very low	50.6	Low	107 Å²	107	100.3 Å²	100.3	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-41.7	177.1	-74.7	176.5	174.2	0	0	111.8	K45 I46 L51 S52 L53	K45-E49 PolarHBondContact O-N 3.26Å; I46-E49 PolarHBondContact O-N 2.86Å; E49-L51 PolarHBondContact O-N 2.89Å; E49-S52 PolarHBondContact O-N 3.04Å; E49-L53 WeakPolarHBondContact O-CB 3.32Å; E49-L53 PolarHBondContact O-N 3.39Å
50	C	44	Very low	50.6	Low	75 Å²	75	99.9 Å²	99.9	51%	0.507	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-39.3	174.8	-71.5	0	0	0	0	113	I46 R54	I46-C50 WeakPolarHBondContact O-CB 3.4Å; I46-C50 PolarHBondContact O-N 2.71Å; I46-C50 PolarHBondContact O-SG 2.98Å; C50-R54 WeakPolarHBondContact O-CB 3.23Å; C50-R54 PolarHBondContact O-N 2.78Å
51	L	57.3	Low	50.2	Low	111 Å²	111	102.4 Å²	102.4	58%	0.581	55%	0.546	S	S	*	.	H	α-helix	trans	-70.5	-39.1	175.9	-72	170.8	0	0	0	112	L47 A48 E49 R54 A55	L47-L51 WeakPolarHBondContact O-CB 3.43Å; L47-L51 VanDerWaalsContact O-CG 3.29Å; L47-L51 WeakPolarHBondContact O-CG 3.27Å; L47-L51 PolarHBondContact O-N 2.96Å; A48-L51 PolarHBondContact O-N 3.29Å; E49-L51 PolarHBondContact O-N 2.89Å; L51-R54 PolarHBondContact O-N 2.88Å; L51-A55 PolarHBondContact O-N 2.96Å
52	S	52	Low	49.8	Very low	73 Å²	73	105.7 Å²	105.7	51%	0.51	56%	0.559	S	S	.	*	H	α-helix	trans	-63.1	-45.9	175	-170.2	0	0	0	0	111.8	A48 E49 R54 A55 V56	A48-S52 WeakPolarHBondContact O-CB 3.48Å; A48-S52 PolarHBondContact O-N 2.81Å; E49-S52 PolarHBondContact O-N 3.04Å; S52-R54 VanDerWaalsContact C-N 3.34Å; S52-R54 PolarHBondContact O-N 2.74Å; S52-A55 WeakPolarHBondContact O-CB 3.33Å; S52-A55 PolarHBondContact O-N 2.79Å; S52-A55 VanDerWaalsContact O-N 3.17Å; S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 3.16Å
53	L	45.3	Very low	49.6	Very low	109 Å²	109	103.9 Å²	103.9	57%	0.571	57%	0.573	S	S	*	*	H	α-helix	trans	-59	-42.7	173.3	-85.7	157	0	0	0	112.1	E49 A55 V56 I57	E49-L53 WeakPolarHBondContact O-CB 3.32Å; E49-L53 PolarHBondContact O-N 3.39Å; L53-A55 VanDerWaalsContact C-N 3.34Å; L53-A55 PolarHBondContact O-N 3.15Å; L53-V56 PolarHBondContact O-N 2.9Å; L53-I57 WeakPolarHBondContact O-CB 3.45Å; L53-I57 WeakPolarHBondContact O-CD1 3.37Å; L53-I57 VanDerWaalsContact O-CG1 3.26Å; L53-I57 WeakPolarHBondContact O-CG1 3.29Å; L53-I57 PolarHBondContact O-N 2.87Å
54	R	47.8	Very low	48.8	Very low	167 Å²	167	110 Å²	110	63%	0.63	60%	0.599	S	S	*	*	H	α-helix	trans	-63.4	-37.7	175.8	-172.1	177	-179	-175.7	-0.9	112.4	C50 L51 S52 N58	C50-R54 WeakPolarHBondContact O-CB 3.23Å; C50-R54 PolarHBondContact O-N 2.78Å; L51-R54 PolarHBondContact O-N 2.88Å; S52-R54 VanDerWaalsContact C-N 3.34Å; S52-R54 PolarHBondContact O-N 2.74Å; R54-N58 WeakPolarHBondContact O-CB 3.29Å; R54-N58 VanDerWaalsContact O-CG 3.28Å; R54-N58 PolarHBondContact O-N 2.86Å
55	A	54.1	Low	48.1	Very low	59 Å²	59	108.9 Å²	108.9	49%	0.488	60%	0.603	S	S	.	*	H	α-helix	trans	-66.2	-47	174.6	0	0	0	0	0	111.8	L51 S52 L53 I57 N58 S59	L51-A55 PolarHBondContact O-N 2.96Å; S52-A55 WeakPolarHBondContact O-CB 3.33Å; S52-A55 PolarHBondContact O-N 2.79Å; S52-A55 VanDerWaalsContact O-N 3.17Å; L53-A55 VanDerWaalsContact C-N 3.34Å; L53-A55 PolarHBondContact O-N 3.15Å; A55-I57 PolarHBondContact O-N 3.16Å; A55-N58 PolarHBondContact O-N 2.98Å; A55-S59 PolarHBondContact O-N 2.79Å; A55-S59 PolarHBondContact O-OG 3.37Å
56	V	48.8	Very low	47.7	Very low	81 Å²	81	108.1 Å²	108.1	49%	0.491	61%	0.612	S	S	.	*	H	α-helix	trans	-59.3	-45.1	177.3	171.7	0	0	0	0	111.4	S52 L53 N58 S59 S60	S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 3.16Å; L53-V56 PolarHBondContact O-N 2.9Å; V56-N58 PolarHBondContact O-N 3.21Å; V56-S59 WeakPolarHBondContact CA-OG 3.28Å; V56-S59 PolarHBondContact O-N 2.88Å; V56-S59 PolarHBondContact O-OG 2.83Å; V56-S60 PolarHBondContact O-N 2.93Å; V56-S60 PolarHBondContact O-OG 3.32Å
57	I	45.3	Very low	47.1	Very low	114 Å²	114	111.1 Å²	111.1	59%	0.585	64%	0.635	S	S	*	*	H	α-helix	trans	-61.5	-44.8	176.4	-69.5	165	0	0	0	111.1	L53 A55 S59 S60	L53-I57 WeakPolarHBondContact O-CB 3.45Å; L53-I57 WeakPolarHBondContact O-CD1 3.37Å; L53-I57 VanDerWaalsContact O-CG1 3.26Å; L53-I57 WeakPolarHBondContact O-CG1 3.29Å; L53-I57 PolarHBondContact O-N 2.87Å; A55-I57 PolarHBondContact O-N 3.16Å; I57-S59 VanDerWaalsContact C-N 3.29Å; I57-S59 PolarHBondContact O-N 2.9Å; I57-S60 WeakPolarHBondContact O-CB 3.35Å; I57-S60 PolarHBondContact O-N 3.03Å; I57-S60 VanDerWaalsContact O-N 3.11Å
58	N	54.7	Low	46.6	Very low	124 Å²	124	111.8 Å²	111.8	66%	0.663	65%	0.646	S	S	*	*	H	α-helix	trans	-66.3	-28.5	176.9	-74.3	-2.6	0	0	0	113.3	R54 A55 V56 S60	R54-N58 WeakPolarHBondContact O-CB 3.29Å; R54-N58 VanDerWaalsContact O-CG 3.28Å; R54-N58 PolarHBondContact O-N 2.86Å; A55-N58 PolarHBondContact O-N 2.98Å; V56-N58 PolarHBondContact O-N 3.21Å; N58-S60 VanDerWaalsContact C-N 3.34Å
59	S	49.5	Very low	46.1	Very low	88 Å²	88	114.1 Å²	114.1	62%	0.615	67%	0.666	S	S	*	*	H	α-helix	trans	-81.3	-11.4	173.6	68.4	0	0	0	0	113.9	A55 V56 I57 N61	A55-S59 PolarHBondContact O-N 2.79Å; A55-S59 PolarHBondContact O-OG 3.37Å; V56-S59 WeakPolarHBondContact CA-OG 3.28Å; V56-S59 PolarHBondContact O-N 2.88Å; V56-S59 PolarHBondContact O-OG 2.83Å; I57-S59 VanDerWaalsContact C-N 3.29Å; I57-S59 PolarHBondContact O-N 2.9Å; S59-N61 PolarHBondContact O-N 3.38Å
60	S	46.1	Very low	45.5	Very low	66 Å²	66	113.7 Å²	113.7	46%	0.462	68%	0.681	S	S	.	*			trans	-79.1	70.6	179.9	-62	0	0	0	0	110.7	V56 I57 N58 F62	V56-S60 PolarHBondContact O-N 2.93Å; V56-S60 PolarHBondContact O-OG 3.32Å; I57-S60 WeakPolarHBondContact O-CB 3.35Å; I57-S60 PolarHBondContact O-N 3.03Å; I57-S60 VanDerWaalsContact O-N 3.11Å; N58-S60 VanDerWaalsContact C-N 3.34Å; S60-F62 PolarHBondContact O-N 2.81Å
61	N	45.3	Very low	44.8	Very low	158 Å²	158	115.1 Å²	115.1	85%	0.845	70%	0.697	S	S	*	*			trans	-72.6	84.6	-167.1	-149.4	7	0	0	0	112	S59 G63	S59-N61 PolarHBondContact O-N 3.38Å; N61-G63 PolarHBondContact O-N 3.04Å; N61-G63 VanDerWaalsContact O-N 3.16Å
62	F	40.8	Very low	43.6	Very low	209 Å²	209	115.3 Å²	115.3	92%	0.917	71%	0.708	S	S	*	*			trans	-68.8	107.7	179.3	-103	-89.6	0	0	0	111.6	S60	S60-F62 PolarHBondContact O-N 2.81Å
63	G	46	Very low	42.5	Very low	77 Å²	77	118.7 Å²	118.7	79%	0.794	73%	0.726	S	S	*	*			trans	102.8	88	158.8	0	0	0	0	0	116.4	N61	N61-G63 PolarHBondContact O-N 3.04Å; N61-G63 VanDerWaalsContact O-N 3.16Å
64	K	36.3	Very low	41.7	Very low	198 Å²	198	120.6 Å²	120.6	86%	0.861	74%	0.735	S	S	*	*			trans	-148.9	131.3	148.4	-153.7	171.1	-172.5	178.1	0	110.5
65	P	42.4	Very low	40.7	Very low	112 Å²	112	118 Å²	118	73%	0.727	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-73.3	155.5	176.3	30.7	-35.1	0	0	0	111.6
66	P	40.1	Very low	39.5	Very low	119 Å²	119	123.1 Å²	123.1	77%	0.773	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-75.2	149.5	179.3	31.6	-35.5	0	0	0	112.4
67	P	40.8	Very low	39.3	Very low	116 Å²	116	124.1 Å²	124.1	75%	0.753	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-75.6	155.6	168.6	33.2	-34.5	0	0	0	111.6
68	P	42.9	Very low	38.3	Very low	127 Å²	127	124.6 Å²	124.6	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-75.2	156	177.6	32.1	-35.7	0	0	0	112.6
69	A	42.1	Very low	36.9	Very low	107 Å²	107	127.5 Å²	127.5	88%	0.884	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.4	148.2	177.6	0	0	0	0	0	112.8
70	A	33.2	Very low	36.5	Very low	98 Å²	98	128.2 Å²	128.2	81%	0.81	79%	0.793	S	S	*	*			trans	-145	123.2	174.7	0	0	0	0	0	112.9
71	A	30.5	Very low	35.5	Very low	104 Å²	104	129.9 Å²	129.9	86%	0.86	81%	0.805	S	S	*	*			trans	37.1	134.6	152.3	0	0	0	0	0	122.8
72	S	31.3	Very low	34.5	Very low	115 Å²	115	128.1 Å²	128.1	80%	0.804	80%	0.8	S	S	*	*			trans	-72.3	159.9	169.5	-33.7	0	0	0	0	114
73	T	28.5	Very low	33.8	Very low	144 Å²	144	123.4 Å²	123.4	88%	0.883	79%	0.793	S	S	*	*			trans	-155.2	136.8	142.4	-77.7	0	0	0	0	113
74	I	30.1	Very low	33.1	Very low	150 Å²	150	129 Å²	129	77%	0.769	80%	0.795	S	S	*	*			trans	-61.3	148.6	-178.2	-57.7	151.1	0	0	0	114
75	S	26.5	Very low	32.6	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	80%	0.795	S	S	*	*				169.6	144.9	126.6	-74.4	0	0	0	0	117
76	L	28	Very low	32.7	Very low	167 Å²	167	128.3 Å²	128.3	87%	0.874	80%	0.795	S	S	*	*			trans	-133.6	-175.3	161.9	-112.7	107	0	0	0	106.2
77	P	44.9	Very low	32.1	Very low	102 Å²	102	129.2 Å²	129.2	66%	0.662	79%	0.794	S	S	*	*			cis	-132.1	-174	-7.1	35.5	-15.2	0	0	0	114
78	C	23.8	Very low	31.6	Very low	124 Å²	124	128.9 Å²	128.9	84%	0.838	79%	0.794	S	S	*	*				164.3	163.3	124.6	-89.5	0	0	0	0	115.1
79	Q	26.6	Very low	31	Very low	185 Å²	185	128.5 Å²	128.5	86%	0.864	79%	0.794	S	S	*	*			trans	-119.7	-155.4	179.4	-45.2	178.9	-54.6	0	0	109.8
80	P	40.3	Very low	30.5	Very low	103 Å²	103	127.2 Å²	127.2	67%	0.669	78%	0.784	S	S	*	*			cis	-137	-161.8	-18.2	31.7	-7.2	0	0	0	114.6
81	S	25.3	Very low	30.3	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	78%	0.784	S	S	*	*			trans	84.2	146.8	152.2	-59.6	0	0	0	0	119.4
82	T	24.1	Very low	30.2	Very low	122 Å²	122	131.8 Å²	131.8	75%	0.748	78%	0.779	S	S	*	*			cis	-166.8	150.3	-6	18	0	0	0	0	113.1
83	S	26.4	Very low	30.1	Very low	110 Å²	110	132.4 Å²	132.4	77%	0.769	78%	0.778	S	S	*	*			trans	69	160.2	154.2	77.6	0	0	0	0	118.4
84	K	31.5	Very low	30.9	Very low	195 Å²	195	130.8 Å²	130.8	85%	0.848	77%	0.77	S	S	*	*			cis	-162.4	150.1	11.5	-144.7	168.4	-175.1	179.7	0	111.4
85	E	25.9	Very low	30.8	Very low	180 Å²	180	130.6 Å²	130.6	84%	0.841	77%	0.769	S	S	*	*			trans	-108.2	-178.8	163.2	-50.8	-170.5	132.6	0	0	111
86	P	43.8	Very low	30.8	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	76%	0.763	S	S	*	*				-139.2	-162.9	60.3	45.9	-27.1	0	0	0	112.8
87	D	28.2	Very low	30.8	Very low	139 Å²	139	128 Å²	128	74%	0.743	76%	0.759	S	S	*	*			cis	-160.8	163.6	2.7	-145.4	-43.5	0	0	0	112.5
88	S	30.4	Very low	30	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	77%	0.768	S	S	*	*			trans	68.9	149.6	155.5	82.5	0	0	0	0	120.3
89	S	29.2	Very low	30.1	Very low	119 Å²	119	133.3 Å²	133.3	83%	0.832	76%	0.761	S	S	*	*			cis	-143.9	171.9	3.7	69.4	0	0	0	0	113.4
90	A	31.3	Very low	30.3	Very low	81 Å²	81	129.9 Å²	129.9	67%	0.669	75%	0.753	S	S	*	*			trans	-85.9	162.6	-158.3	0	0	0	0	0	117.5
91	H	28.8	Very low	29.5	Very low	175 Å²	175	133.1 Å²	133.1	81%	0.81	76%	0.759	S	S	*	*				-171.5	133	105.2	-106.7	-70	0	0	0	117.4
92	T	29	Very low	29.6	Very low	122 Å²	122	133.5 Å²	133.5	75%	0.748	76%	0.762	S	S	*	*			trans	61.8	118.5	144.4	-51.4	0	0	0	0	122.2
93	T	29.8	Very low	29.8	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	76%	0.759	S	S	*	*			trans	-102.2	-176.3	166.3	56.8	0	0	0	0	109.8
94	P	45.1	Very low	30	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	75%	0.753	S	S	*	*			cis	-144.3	-167.2	43.5	45.3	-21.6	0	0	0	114.3
95	I	27	Very low	29.8	Very low	146 Å²	146	133.9 Å²	133.9	75%	0.749	75%	0.748	S	S	*	*			cis	-153.2	161.8	11.9	-150.9	152.3	0	0	0	114
96	S	27.8	Very low	30.6	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	74%	0.743	S	S	*	*			trans	-6	159.7	154.1	-56.3	0	0	0	0	121.6
97	T	27.7	Very low	30	Very low	131 Å²	131	132 Å²	132	80%	0.804	75%	0.746	S	S	*	*			cis	-170.3	168.8	-5	29.4	0	0	0	0	106.5
98	R	28.1	Very low	30.2	Very low	224 Å²	224	130.6 Å²	130.6	85%	0.845	75%	0.747	S	S	*	*			cis	-171.9	163.1	46.8	-171.7	168.8	170	173.6	-4.5	111.8
99	T	26.7	Very low	30.5	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.693	75%	0.754	S	S	*	*			trans	-38.8	160.5	162.6	9.8	0	0	0	0	115.8
100	V	29.8	Very low	30.6	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.685	75%	0.754	S	S	*	*			cis	-156.5	156.4	35.2	-131.1	0	0	0	0	115.2
101	E	24.1	Very low	30.7	Very low	171 Å²	171	134.8 Å²	134.8	80%	0.799	76%	0.76	S	S	*	*			trans	42.1	133.3	140.3	-86.2	178.5	119.6	0	0	126.6
102	S	27	Very low	30.9	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	76%	0.757	S	S	*	*				77.8	142.4	125.8	-168.3	0	0	0	0	120.6
103	K	27.9	Very low	31.1	Very low	159 Å²	159	132.3 Å²	132.3	69%	0.691	76%	0.761	S	S	*	*			cis	-178.6	155	-18.8	-172.8	-170.8	178.4	-140.5	0	108.1
104	H	30.3	Very low	31.3	Very low	141 Å²	141	130.4 Å²	130.4	65%	0.653	75%	0.753	S	S	*	*			trans	69.2	152.2	176.6	-61.6	-81.7	0	0	0	115.6
105	D	28.3	Very low	31.5	Very low	136 Å²	136	131 Å²	131	73%	0.727	75%	0.754	S	S	*	*			cis	-148.7	-177.1	-10.3	-134.4	-62.5	0	0	0	112.8
106	V	42.3	Very low	31.6	Very low	123 Å²	123	135 Å²	135	75%	0.745	76%	0.76	S	S	*	*			trans	-73.7	142.3	-174.6	176.7	0	0	0	0	114.5
107	T	31.1	Very low	32	Very low	131 Å²	131	139.5 Å²	139.5	80%	0.804	77%	0.771	S	S	*	*			trans	-175.6	132	137.8	-82.7	0	0	0	0	114.9
108	S	33.4	Very low	32.5	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	77%	0.774	S	S	*	*			trans	48.7	147	153.3	-159.4	0	0	0	0	123.2
109	M	35.1	Very low	32.7	Very low	181 Å²	181	140.2 Å²	140.2	89%	0.892	78%	0.775	S	S	*	*			trans	-68.3	145.5	164.7	-58	-179.9	-71.1	0	0	112.1
110	A	32	Very low	33	Very low	102 Å²	102	143 Å²	143	84%	0.843	78%	0.784	S	S	*	*			trans	-146.6	151.5	158.5	0	0	0	0	0	109.6
111	S	33.3	Very low	33.4	Very low	112 Å²	112	147.1 Å²	147.1	78%	0.783	80%	0.795	S	S	*	*			trans	-68.3	146.7	-174.7	-174.9	0	0	0	0	112.8	V113	S111-V113 PolarHBondContact O-N 3.41Å
112	S	34.2	Very low	34	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	79%	0.792	S	S	*	*			trans	-56.1	133.5	161.5	-52.6	0	0	0	0	110.5
113	V	32.6	Very low	34.1	Very low	137 Å²	137	146.6 Å²	146.6	83%	0.83	80%	0.801	S	S	*	*			trans	-119.7	114.3	167.6	175.2	0	0	0	0	107.1	S111	S111-V113 PolarHBondContact O-N 3.41Å
114	S	32.8	Very low	34.4	Very low	89 Å²	89	143.4 Å²	143.4	62%	0.622	80%	0.804	S	S	*	*			trans	-95.6	103.1	-174.9	-61.6	0	0	0	0	112	W116	S114-W116 PolarHBondContact O-N 2.61Å
115	T	49.3	Very low	34.3	Very low	122 Å²	122	145.3 Å²	145.3	75%	0.748	81%	0.811	S	S	*	*			trans	14.2	99.6	143.5	23.2	0	0	0	0	117.9
116	W	31.1	Very low	34.4	Very low	230 Å²	230	146.2 Å²	146.2	87%	0.871	81%	0.814	S	S	*	*			trans	-150.9	33.8	166	-79.3	107.1	0	0	0	112.6	S114	S114-W116 PolarHBondContact O-N 2.61Å
117	H	35.6	Very low	33.8	Very low	187 Å²	187	147.2 Å²	147.2	87%	0.866	82%	0.815	S	S	*	*			trans	-118.4	2.2	-166.7	-82.3	104.6	0	0	0	116.9
118	E	36.8	Very low	33.6	Very low	187 Å²	187	144 Å²	144	87%	0.874	81%	0.808	S	S	*	*	S	Bend	trans	-116.1	13.8	-167.3	-64.5	-175.3	145.3	0	0	115.7
119	E	32.8	Very low	33.3	Very low	183 Å²	183	146.6 Å²	146.6	86%	0.855	81%	0.813	S	S	*	*	S	Bend	trans	-121.8	24	-174.4	-147.2	177.1	-151.5	0	0	114.8
120	I	33.6	Very low	33.4	Very low	173 Å²	173	141.1 Å²	141.1	89%	0.887	80%	0.797	S	S	*	*			trans	-133.3	40.1	172.9	-37.6	-179.9	0	0	0	111.9
121	E	38.2	Very low	33.5	Very low	198 Å²	198	143.3 Å²	143.3	93%	0.925	79%	0.794	S	S	*	*			trans	-113.8	47.5	166.8	-161.1	171.1	-148.5	0	0	110.9
122	A	37.1	Very low	33.7	Very low	87 Å²	87	146.3 Å²	146.3	72%	0.719	80%	0.796	S	S	*	*			trans	-146.6	59.8	-176.2	0	0	0	0	0	113.2
123	L	28.8	Very low	33.5	Very low	183 Å²	183	151.1 Å²	151.1	96%	0.958	80%	0.803	S	S	*	*			trans	-175.9	119.6	142.7	-101.6	163.4	0	0	0	109.2
124	A	33	Very low	33.5	Very low	92 Å²	92	148.4 Å²	148.4	76%	0.76	80%	0.795	S	S	*	*			trans	-111.6	162.9	-174.9	0	0	0	0	0	112.8
125	F	29.2	Very low	33.3	Very low	180 Å²	180	152.9 Å²	152.9	79%	0.789	81%	0.809	S	S	*	*			trans	85.3	164.5	152.5	-146.1	-101.6	0	0	0	119.1
126	I	30.1	Very low	32.5	Very low	156 Å²	156	154.4 Å²	154.4	80%	0.8	81%	0.811	S	S	*	*			trans	73.2	98.5	-169.9	-46.4	176.5	0	0	0	112
127	D	30.5	Very low	32.2	Very low	144 Å²	144	150 Å²	150	77%	0.77	81%	0.809	S	S	*	*			cis	116.2	145.6	19.5	-169	26.7	0	0	0	111.4
128	G	26	Very low	32.1	Very low	62 Å²	62	149.5 Å²	149.5	64%	0.639	81%	0.808	S	S	*	*			trans	103.6	108.2	-167.1	0	0	0	0	0	112.8
129	D	28.2	Very low	32.6	Very low	165 Å²	165	146.3 Å²	146.3	88%	0.882	80%	0.803	S	S	*	*			cis	81.6	128.5	48.3	-157.7	52.9	0	0	0	112
130	A	35.5	Very low	32.3	Very low	67 Å²	67	142 Å²	142	55%	0.554	80%	0.798	S	S	*	*			cis	-149.8	172.5	8.6	0	0	0	0	0	113.6
131	D	34.9	Very low	32.1	Very low	147 Å²	147	141.7 Å²	141.7	79%	0.786	80%	0.798	S	S	*	*			trans	48	122	153.6	-63.3	-11.6	0	0	0	122
132	E	38.1	Very low	32.4	Very low	175 Å²	175	142.2 Å²	142.2	82%	0.818	80%	0.797	S	S	*	*				70.4	106.9	63.4	-83.8	-107.8	108.6	0	0	116
133	K	28.8	Very low	32.5	Very low	209 Å²	209	145 Å²	145	91%	0.909	81%	0.805	S	S	*	*				-165.2	134	114.9	-145.5	160.1	-169.4	161.2	0	113.5
134	A	34.1	Very low	32.9	Very low	81 Å²	81	138.7 Å²	138.7	67%	0.669	79%	0.785	S	S	*	*			trans	-102.7	159.9	174.3	0	0	0	0	0	113
135	M	27.2	Very low	32.8	Very low	183 Å²	183	145.4 Å²	145.4	90%	0.901	79%	0.79	S	S	*	*			trans	-161.2	151.9	138.9	-106.3	-163.6	79.9	0	0	111.8
136	L	32.8	Very low	33.3	Very low	154 Å²	154	141 Å²	141	81%	0.806	79%	0.787	S	S	*	*			trans	-89.1	160.2	178.9	-62.8	94.9	0	0	0	112.1
137	V	25.4	Very low	33.8	Very low	136 Å²	136	136.7 Å²	136.7	82%	0.824	78%	0.775	S	S	*	*				172.8	135.5	113.3	153.3	0	0	0	0	111.5
138	Q	34.1	Very low	34.1	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	78%	0.776	S	S	*	*			trans	-122.4	168.3	158.9	-74	-166.2	30.7	0	0	107.2
139	P	47	Very low	34.8	Very low	119 Å²	119	139.9 Å²	139.9	77%	0.773	77%	0.771	S	S	*	*			cis	-136.5	161.3	11.3	40.2	-23.4	0	0	0	116.6
140	A	26.1	Very low	35.5	Very low	92 Å²	92	137.5 Å²	137.5	76%	0.76	75%	0.754	S	S	*	*			trans	-153.8	151.5	158.8	0	0	0	0	0	113.1
141	L	30	Very low	35.9	Very low	167 Å²	167	136.3 Å²	136.3	87%	0.874	75%	0.745	S	S	*	*			trans	59.9	98.9	163	-68.9	158.2	0	0	0	118.6	T143	L141-T143 PolarHBondContact O-N 3Å
142	K	43	Very low	36.5	Very low	210 Å²	210	133.2 Å²	133.2	91%	0.913	74%	0.735	S	S	*	*			trans	-72.6	103.2	171	-63.9	171.6	177.4	175.8	0	112.4
143	T	40.8	Very low	37.2	Very low	144 Å²	144	130.8 Å²	130.8	88%	0.883	72%	0.721	S	S	*	*			trans	-157.7	75	158.1	19.1	0	0	0	0	110.9	L141	L141-T143 PolarHBondContact O-N 3Å
144	G	36.1	Very low	38.5	Very low	52 Å²	52	126.9 Å²	126.9	54%	0.536	70%	0.704	S	S	.	*			trans	-176.5	-12.1	179.3	0	0	0	0	0	118.8	A146 A147	G144-A146 PolarHBondContact O-N 3.31Å; G144-A146 VanDerWaalsContact O-N 3.07Å; G144-A147 PolarHBondContact O-N 3.24Å
145	W	31.1	Very low	39.2	Very low	232 Å²	232	127.6 Å²	127.6	88%	0.879	70%	0.697	S	S	*	*	H	α-helix	trans	-60.3	-27.7	-168	-143.1	-72.4	0	0	0	115	A147	W145-A147 VanDerWaalsContact C-N 3.3Å; W145-A147 PolarHBondContact O-N 2.74Å
146	A	39.1	Very low	40.2	Very low	87 Å²	87	120.9 Å²	120.9	72%	0.719	67%	0.67	S	S	*	*	H	α-helix	trans	-71.6	-17.8	178	0	0	0	0	0	114.5	G144	G144-A146 PolarHBondContact O-N 3.31Å; G144-A146 VanDerWaalsContact O-N 3.07Å
147	A	40.8	Very low	41.3	Very low	67 Å²	67	118.7 Å²	118.7	55%	0.554	66%	0.656	S	S	*	*	H	α-helix	trans	-85.9	-36.7	-177.5	0	0	0	0	0	112.9	G144 W145 Q150 A151	G144-A147 PolarHBondContact O-N 3.24Å; W145-A147 VanDerWaalsContact C-N 3.3Å; W145-A147 PolarHBondContact O-N 2.74Å; A147-Q150 PolarHBondContact O-N 2.84Å; A147-A151 PolarHBondContact O-N 2.64Å
148	M	36.9	Very low	43	Very low	157 Å²	157	116.2 Å²	116.2	77%	0.773	64%	0.641	S	S	*	*	H	α-helix	trans	-72.6	-35.3	-170.6	-155.5	166.1	94.4	0	0	112.8	Q150 A151 S152	M148-Q150 VanDerWaalsContact C-N 3.31Å; M148-Q150 PolarHBondContact O-N 3.36Å; M148-A151 WeakPolarHBondContact O-CB 3.2Å; M148-A151 PolarHBondContact O-N 2.84Å; M148-S152 PolarHBondContact O-N 2.89Å
149	E	40.9	Very low	43.8	Very low	115 Å²	115	113.1 Å²	113.1	54%	0.537	63%	0.629	S	S	.	*	H	α-helix	trans	-71.6	-26.1	175.9	-155.3	-173.9	122.3	0	0	112.5	K153	E149-K153 WeakPolarHBondContact O-CD 3.27Å; E149-K153 WeakPolarHBondContact O-CG 3.48Å; E149-K153 PolarHBondContact O-N 3.29Å; E149-K153 IonicContact OE1-NZ 3.72Å; E149-K153 PolarHBondContact OE1-NZ 3.06Å
150	Q	43.8	Very low	44.1	Very low	115 Å²	115	112.9 Å²	112.9	54%	0.537	61%	0.613	S	S	.	*	H	α-helix	trans	-73.9	-25.7	170.8	-70.5	-164.2	9.6	0	0	113.1	A147 M148 K154	A147-Q150 PolarHBondContact O-N 2.84Å; M148-Q150 VanDerWaalsContact C-N 3.31Å; M148-Q150 PolarHBondContact O-N 3.36Å; Q150-K154 WeakPolarHBondContact O-CB 3.42Å; Q150-K154 VanDerWaalsContact O-CG 3.29Å; Q150-K154 WeakPolarHBondContact O-CG 3.47Å; Q150-K154 PolarHBondContact O-N 3.43Å; Q150-K154 VanDerWaalsContact O-N 3.1Å
151	A	42.2	Very low	45.9	Very low	43 Å²	43	110.7 Å²	110.7	36%	0.355	59%	0.592	S	S	.	*	H	α-helix	trans	-65.8	-59.8	176.2	0	0	0	0	0	110	A147 M148 K153 K154 D155	A147-A151 PolarHBondContact O-N 2.64Å; M148-A151 WeakPolarHBondContact O-CB 3.2Å; M148-A151 PolarHBondContact O-N 2.84Å; A151-K153 PolarHBondContact O-N 3.27Å; A151-K153 VanDerWaalsContact O-N 3.12Å; A151-K154 CarbonylContact O-C 3.54Å; A151-K154 WeakPolarHBondContact O-CA 3.45Å; A151-K154 WeakPolarHBondContact O-CB 3.4Å; A151-K154 PolarHBondContact O-N 3.47Å; A151-D155 VanDerWaalsContact O-CG 3.3Å; A151-D155 PolarHBondContact O-N 2.92Å; A151-D155 VanDerWaalsContact O-OD2 3.09Å
152	S	48.2	Very low	47	Very low	82 Å²	82	107.9 Å²	107.9	57%	0.573	57%	0.574	S	S	*	*	H	α-helix	trans	-54	-37.6	178.3	177.2	0	0	0	0	113.2	M148 D155 A156	M148-S152 PolarHBondContact O-N 2.89Å; S152-D155 PolarHBondContact O-N 3.3Å; S152-A156 WeakPolarHBondContact O-CB 3.48Å; S152-A156 PolarHBondContact O-N 3.44Å
153	K	53.8	Low	47.7	Very low	123 Å²	123	102 Å²	102	54%	0.535	56%	0.556	S	S	.	*	H	α-helix	trans	-68.1	-35.9	175.4	-73.2	171.6	177	172.9	0	113.2	E149 A151 E157	E149-K153 WeakPolarHBondContact O-CD 3.27Å; E149-K153 WeakPolarHBondContact O-CG 3.48Å; E149-K153 PolarHBondContact O-N 3.29Å; E149-K153 IonicContact OE1-NZ 3.72Å; E149-K153 PolarHBondContact OE1-NZ 3.06Å; A151-K153 PolarHBondContact O-N 3.27Å; A151-K153 VanDerWaalsContact O-N 3.12Å; K153-E157 PolarHBondContact O-N 3.36Å; K153-E157 VanDerWaalsContact O-N 3.14Å
154	K	54.7	Low	48.6	Very low	128 Å²	128	100.2 Å²	100.2	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-71.9	-39.2	172.5	-76.1	169.8	-178.4	168.9	0	112.1	Q150 A151 A156 E157 V158	Q150-K154 WeakPolarHBondContact O-CB 3.42Å; Q150-K154 VanDerWaalsContact O-CG 3.29Å; Q150-K154 WeakPolarHBondContact O-CG 3.47Å; Q150-K154 PolarHBondContact O-N 3.43Å; Q150-K154 VanDerWaalsContact O-N 3.1Å; A151-K154 CarbonylContact O-C 3.54Å; A151-K154 WeakPolarHBondContact O-CA 3.45Å; A151-K154 WeakPolarHBondContact O-CB 3.4Å; A151-K154 PolarHBondContact O-N 3.47Å; K154-A156 VanDerWaalsContact C-N 3.32Å; K154-A156 PolarHBondContact O-N 3.11Å; K154-E157 WeakPolarHBondContact O-CA 3.37Å; K154-E157 WeakPolarHBondContact O-CB 3.17Å; K154-E157 PolarHBondContact O-N 3.35Å; K154-V158 WeakPolarHBondContact O-CG2 3.47Å; K154-V158 PolarHBondContact O-N 2.76Å
155	D	49.8	Very low	49.6	Very low	95 Å²	95	103 Å²	103	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-40.3	177.5	-58.8	-38.1	0	0	0	110.3	A151 S152 E157 V158 I159	A151-D155 VanDerWaalsContact O-CG 3.3Å; A151-D155 PolarHBondContact O-N 2.92Å; A151-D155 VanDerWaalsContact O-OD2 3.09Å; S152-D155 PolarHBondContact O-N 3.3Å; D155-E157 VanDerWaalsContact C-N 3.29Å; D155-E157 PolarHBondContact O-N 3.02Å; D155-V158 PolarHBondContact O-N 2.98Å; D155-I159 VanDerWaalsContact O-CG1 3.27Å; D155-I159 WeakPolarHBondContact O-CG1 3.26Å; D155-I159 PolarHBondContact O-N 3.28Å
156	A	48.6	Very low	50.5	Low	42 Å²	42	96.7 Å²	96.7	35%	0.347	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-27.6	169.9	0	0	0	0	0	114	S152 K154 R160	S152-A156 WeakPolarHBondContact O-CB 3.48Å; S152-A156 PolarHBondContact O-N 3.44Å; K154-A156 VanDerWaalsContact C-N 3.32Å; K154-A156 PolarHBondContact O-N 3.11Å; A156-R160 WeakPolarHBondContact O-CB 3.44Å; A156-R160 WeakPolarHBondContact O-CG 3.39Å; A156-R160 PolarHBondContact O-N 2.88Å; A156-R160 VanDerWaalsContact O-N 3.14Å; A156-R160 PolarHBondContact O-NE 3.36Å
157	E	55	Low	51.2	Low	109 Å²	109	95.3 Å²	95.3	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-70.3	-43.6	172.2	-157.1	72.5	-131.2	0	0	111.2	K153 K154 D155 R160 S161	K153-E157 PolarHBondContact O-N 3.36Å; K153-E157 VanDerWaalsContact O-N 3.14Å; K154-E157 WeakPolarHBondContact O-CA 3.37Å; K154-E157 WeakPolarHBondContact O-CB 3.17Å; K154-E157 PolarHBondContact O-N 3.35Å; D155-E157 VanDerWaalsContact C-N 3.29Å; D155-E157 PolarHBondContact O-N 3.02Å; E157-R160 VanDerWaalsContact CA-NH2 3.33Å; E157-R160 VanDerWaalsContact CD-NH2 3.28Å; E157-R160 PolarHBondContact O-N 2.98Å; E157-R160 IonicContact OE1-CZ 2.7Å; E157-R160 IonicContact OE1-NH1 2.59Å; E157-R160 PolarHBondContact OE1-NH1 3.44Å; E157-R160 IonicContact OE1-NH2 2.69Å; E157-R160 IonicContact OE2-CZ 2.71Å; E157-R160 IonicContact OE2-NH1 3.82Å; E157-R160 PolarHBondContact OE2-NH1 2.87Å; E157-R160 VanDerWaalsContact OE2-NH1 3.12Å; E157-R160 IonicContact OE2-NH2 2.73Å; E157-R160 PolarHBondContact OE2-NH2 3.35Å; E157-S161 WeakPolarHBondContact O-CB 3.29Å; E157-S161 PolarHBondContact O-N 2.95Å
158	V	61.3	Low	52	Low	84 Å²	84	94.5 Å²	94.5	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-66.4	-42.5	177.1	173.6	0	0	0	0	111.1	K154 D155 S161 H162	K154-V158 WeakPolarHBondContact O-CG2 3.47Å; K154-V158 PolarHBondContact O-N 2.76Å; D155-V158 PolarHBondContact O-N 2.98Å; V158-S161 PolarHBondContact O-N 3.21Å; V158-H162 PolarHBondContact O-N 2.98Å
159	I	50.5	Low	53	Low	113 Å²	113	91.2 Å²	91.2	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-61.2	-47.1	175.5	-69.3	164.2	0	0	0	110.5	D155 S161 H162 V163	D155-I159 VanDerWaalsContact O-CG1 3.27Å; D155-I159 WeakPolarHBondContact O-CG1 3.26Å; D155-I159 PolarHBondContact O-N 3.28Å; I159-S161 PolarHBondContact O-N 2.88Å; I159-H162 PolarHBondContact O-N 2.88Å; I159-H162 VanDerWaalsContact O-N 3.08Å; I159-V163 PolarHBondContact O-N 3.47Å
160	R	52.7	Low	53.3	Low	114 Å²	114	88.5 Å²	88.5	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-56.3	-49.4	173.2	-81.5	177	-76.3	123.9	-4.4	111.7	A156 E157 H162 V163 D164	A156-R160 WeakPolarHBondContact O-CB 3.44Å; A156-R160 WeakPolarHBondContact O-CG 3.39Å; A156-R160 PolarHBondContact O-N 2.88Å; A156-R160 VanDerWaalsContact O-N 3.14Å; A156-R160 PolarHBondContact O-NE 3.36Å; E157-R160 VanDerWaalsContact CA-NH2 3.33Å; E157-R160 VanDerWaalsContact CD-NH2 3.28Å; E157-R160 PolarHBondContact O-N 2.98Å; E157-R160 IonicContact OE1-CZ 2.7Å; E157-R160 IonicContact OE1-NH1 2.59Å; E157-R160 PolarHBondContact OE1-NH1 3.44Å; E157-R160 IonicContact OE1-NH2 2.69Å; E157-R160 IonicContact OE2-CZ 2.71Å; E157-R160 IonicContact OE2-NH1 3.82Å; E157-R160 PolarHBondContact OE2-NH1 2.87Å; E157-R160 VanDerWaalsContact OE2-NH1 3.12Å; E157-R160 IonicContact OE2-NH2 2.73Å; E157-R160 PolarHBondContact OE2-NH2 3.35Å; R160-H162 PolarHBondContact O-N 3.07Å; R160-H162 VanDerWaalsContact O-N 3.1Å; R160-V163 PolarHBondContact O-N 3.28Å; R160-D164 VanDerWaalsContact O-CG 3.26Å; R160-D164 PolarHBondContact O-N 3.41Å
161	S	65.4	Low	53.8	Low	45 Å²	45	87.7 Å²	87.7	32%	0.315	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-27	176.4	-172.6	0	0	0	0	114	E157 V158 I159 K165	E157-S161 WeakPolarHBondContact O-CB 3.29Å; E157-S161 PolarHBondContact O-N 2.95Å; V158-S161 PolarHBondContact O-N 3.21Å; I159-S161 PolarHBondContact O-N 2.88Å; S161-K165 VanDerWaalsContact O-CD 3.24Å; S161-K165 WeakPolarHBondContact O-CD 3.42Å; S161-K165 WeakPolarHBondContact O-CG 3.36Å; S161-K165 PolarHBondContact O-N 2.98Å; S161-K165 PolarHBondContact OG-NZ 3.31Å
162	H	52.8	Low	54.2	Low	109 Å²	109	90.9 Å²	90.9	51%	0.505	49%	0.485	S	S	.	.	H	α-helix	trans	-80.9	-37.7	173.9	-78.1	-169	0	0	0	112.7	V158 I159 R160 K165 L166	V158-H162 PolarHBondContact O-N 2.98Å; I159-H162 PolarHBondContact O-N 2.88Å; I159-H162 VanDerWaalsContact O-N 3.08Å; R160-H162 PolarHBondContact O-N 3.07Å; R160-H162 VanDerWaalsContact O-N 3.1Å; H162-K165 PolarHBondContact O-N 3.41Å; H162-L166 WeakPolarHBondContact O-CG 3.38Å; H162-L166 PolarHBondContact O-N 2.93Å
163	V	56.6	Low	54.2	Low	87 Å²	87	89.5 Å²	89.5	53%	0.527	47%	0.471	S	S	.	.	H	α-helix	trans	-62.1	-43.4	170.7	175.7	0	0	0	0	110.8	I159 R160 K165 L166 A167	I159-V163 PolarHBondContact O-N 3.47Å; R160-V163 PolarHBondContact O-N 3.28Å; V163-K165 VanDerWaalsContact C-N 3.33Å; V163-K165 PolarHBondContact O-N 3.37Å; V163-L166 PolarHBondContact O-N 3.5Å; V163-L166 VanDerWaalsContact O-N 3.15Å; V163-A167 PolarHBondContact O-N 3.15Å
164	D	60.4	Low	54.1	Low	106 Å²	106	87.8 Å²	87.8	57%	0.567	47%	0.474	S	S	*	.	H	α-helix	trans	-61.7	-38.6	176.6	-63.2	-35.5	0	0	0	112.3	R160 A167 S168	R160-D164 VanDerWaalsContact O-CG 3.26Å; R160-D164 PolarHBondContact O-N 3.41Å; D164-A167 PolarHBondContact O-N 2.75Å; D164-S168 WeakPolarHBondContact O-CB 3.21Å; D164-S168 PolarHBondContact O-N 2.9Å
165	K	57.9	Low	54	Low	110 Å²	110	88.8 Å²	88.8	48%	0.478	48%	0.479	S	S	.	.	H	α-helix	trans	-67.1	-39.7	174.1	-75	163.4	-173.1	137.6	0	112	S161 H162 V163 S168 I169	S161-K165 VanDerWaalsContact O-CD 3.24Å; S161-K165 WeakPolarHBondContact O-CD 3.42Å; S161-K165 WeakPolarHBondContact O-CG 3.36Å; S161-K165 PolarHBondContact O-N 2.98Å; S161-K165 PolarHBondContact OG-NZ 3.31Å; H162-K165 PolarHBondContact O-N 3.41Å; V163-K165 VanDerWaalsContact C-N 3.33Å; V163-K165 PolarHBondContact O-N 3.37Å; K165-S168 PolarHBondContact O-N 3.23Å; K165-I169 VanDerWaalsContact O-CG1 3.29Å; K165-I169 WeakPolarHBondContact O-CG1 3.47Å; K165-I169 PolarHBondContact O-N 2.7Å
166	L	49.9	Very low	53.9	Low	99 Å²	99	92.7 Å²	92.7	52%	0.518	49%	0.486	S	S	.	.	H	α-helix	trans	-65.4	-40.8	174.6	-71.5	169.7	0	0	0	111.4	H162 V163 I169 A170	H162-L166 WeakPolarHBondContact O-CG 3.38Å; H162-L166 PolarHBondContact O-N 2.93Å; V163-L166 PolarHBondContact O-N 3.5Å; V163-L166 VanDerWaalsContact O-N 3.15Å; L166-I169 PolarHBondContact O-N 3.11Å; L166-A170 PolarHBondContact O-N 3.37Å
167	A	53.2	Low	53.9	Low	58 Å²	58	95.6 Å²	95.6	48%	0.479	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-43.7	172.4	0	0	0	0	0	111.7	V163 D164 I169 A170 E171	V163-A167 PolarHBondContact O-N 3.15Å; D164-A167 PolarHBondContact O-N 2.75Å; A167-I169 PolarHBondContact O-N 3.06Å; A167-A170 WeakPolarHBondContact O-CB 3.35Å; A167-A170 PolarHBondContact O-N 3.16Å; A167-E171 WeakPolarHBondContact O-CB 3.31Å; A167-E171 PolarHBondContact O-N 3.47Å
168	S	57.6	Low	53.7	Low	50 Å²	50	94.3 Å²	94.3	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-38.7	175.5	-169.9	0	0	0	0	112.7	D164 K165 E171 Q172	D164-S168 WeakPolarHBondContact O-CB 3.21Å; D164-S168 PolarHBondContact O-N 2.9Å; K165-S168 PolarHBondContact O-N 3.23Å; S168-E171 PolarHBondContact O-N 2.88Å; S168-Q172 VanDerWaalsContact O-CG 3.3Å; S168-Q172 WeakPolarHBondContact O-CG 3.45Å; S168-Q172 PolarHBondContact O-N 3.05Å
169	I	56.7	Low	53.3	Low	89 Å²	89	98 Å²	98	46%	0.456	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-41.6	173.6	-69.6	163.7	0	0	0	110.8	K165 L166 A167 E171 Q172 L173	K165-I169 VanDerWaalsContact O-CG1 3.29Å; K165-I169 WeakPolarHBondContact O-CG1 3.47Å; K165-I169 PolarHBondContact O-N 2.7Å; L166-I169 PolarHBondContact O-N 3.11Å; A167-I169 PolarHBondContact O-N 3.06Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 3.47Å; I169-Q172 PolarHBondContact O-N 3.37Å; I169-L173 HydrophobicContact CG2-CD1 4.13Å; I169-L173 VanDerWaalsContact O-CG 3.32Å; I169-L173 WeakPolarHBondContact O-CG 3.45Å; I169-L173 PolarHBondContact O-N 3.48Å
170	A	49.1	Very low	53.3	Low	57 Å²	57	95 Å²	95	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-38.5	173.8	0	0	0	0	0	112	L166 A167 L173 S174	L166-A170 PolarHBondContact O-N 3.37Å; A167-A170 WeakPolarHBondContact O-CB 3.35Å; A167-A170 PolarHBondContact O-N 3.16Å; A170-L173 PolarHBondContact O-N 3.14Å; A170-S174 WeakPolarHBondContact O-CB 3.36Å; A170-S174 PolarHBondContact O-N 3.37Å
171	E	53.7	Low	53.4	Low	99 Å²	99	92.9 Å²	92.9	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-40.8	174.7	-160.1	-160.6	170.5	0	0	112	A167 S168 I169 L173 S174 K175	A167-E171 WeakPolarHBondContact O-CB 3.31Å; A167-E171 PolarHBondContact O-N 3.47Å; S168-E171 PolarHBondContact O-N 2.88Å; I169-E171 VanDerWaalsContact C-N 3.33Å; I169-E171 PolarHBondContact O-N 3.47Å; E171-L173 VanDerWaalsContact C-N 3.29Å; E171-L173 PolarHBondContact O-N 3.03Å; E171-S174 PolarHBondContact O-N 3.25Å; E171-K175 VanDerWaalsContact CD-NZ 3.31Å; E171-K175 HydrophobicContact CG-CD 4.46Å; E171-K175 WeakPolarHBondContact O-CB 3.37Å; E171-K175 WeakPolarHBondContact O-CG 3.29Å; E171-K175 PolarHBondContact O-N 3.47Å; E171-K175 WeakPolarHBondContact OE1-CE 3.26Å; E171-K175 IonicContact OE1-NZ 3.55Å; E171-K175 PolarHBondContact OE1-NZ 3.18Å; E171-K175 IonicContact OE2-NZ 2.84Å
172	Q	51.2	Low	52.7	Low	109 Å²	109	95.5 Å²	95.5	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-26	173.8	-72.3	176.4	12.8	0	0	113.4	S168 I169 R176	S168-Q172 VanDerWaalsContact O-CG 3.3Å; S168-Q172 WeakPolarHBondContact O-CG 3.45Å; S168-Q172 PolarHBondContact O-N 3.05Å; I169-Q172 PolarHBondContact O-N 3.37Å; Q172-R176 PolarHBondContact O-NE 3.19Å
173	L	47.6	Very low	52.8	Low	53 Å²	53	99.7 Å²	99.7	28%	0.277	54%	0.536	S	S	.	.	H	α-helix	trans	-77.6	-42.5	171.1	-71.5	165.7	0	0	0	111	I169 A170 E171 R176 H177 M192	I169-L173 HydrophobicContact CG2-CD1 4.13Å; I169-L173 VanDerWaalsContact O-CG 3.32Å; I169-L173 WeakPolarHBondContact O-CG 3.45Å; I169-L173 PolarHBondContact O-N 3.48Å; A170-L173 PolarHBondContact O-N 3.14Å; E171-L173 VanDerWaalsContact C-N 3.29Å; E171-L173 PolarHBondContact O-N 3.03Å; L173-R176 PolarHBondContact O-N 3.42Å; L173-R176 VanDerWaalsContact O-N 3.17Å; L173-H177 PolarHBondContact O-N 2.86Å; L173-M192 HydrophobicContact CD2-CE 4.12Å; L173-M192 HydrophobicContact CD2-SD 4.07Å
174	S	51.9	Low	52.8	Low	87 Å²	87	104.7 Å²	104.7	61%	0.608	55%	0.545	S	S	*	.	H	α-helix	trans	-59.8	-46.8	174.1	-173.8	0	0	0	0	112	A170 E171 R176 H177	A170-S174 WeakPolarHBondContact O-CB 3.36Å; A170-S174 PolarHBondContact O-N 3.37Å; E171-S174 PolarHBondContact O-N 3.25Å; S174-R176 PolarHBondContact O-N 3.47Å; S174-R176 VanDerWaalsContact O-N 3.14Å; S174-H177 WeakPolarHBondContact O-CB 3.5Å; S174-H177 PolarHBondContact O-N 3.33Å
175	K	52.5	Low	52.5	Low	149 Å²	149	101.9 Å²	101.9	65%	0.648	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.2	175.9	-76.2	173	179.2	167	0	114.3	E171	E171-K175 VanDerWaalsContact CD-NZ 3.31Å; E171-K175 HydrophobicContact CG-CD 4.46Å; E171-K175 WeakPolarHBondContact O-CB 3.37Å; E171-K175 WeakPolarHBondContact O-CG 3.29Å; E171-K175 PolarHBondContact O-N 3.47Å; E171-K175 WeakPolarHBondContact OE1-CE 3.26Å; E171-K175 IonicContact OE1-NZ 3.55Å; E171-K175 PolarHBondContact OE1-NZ 3.18Å; E171-K175 IonicContact OE2-NZ 2.84Å
176	R	46.8	Very low	52.3	Low	177 Å²	177	103.1 Å²	103.1	67%	0.668	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.5	172.4	-77.7	-169.4	-69.2	179.6	-2.4	114.2	Q172 L173 S174	Q172-R176 PolarHBondContact O-NE 3.19Å; L173-R176 PolarHBondContact O-N 3.42Å; L173-R176 VanDerWaalsContact O-N 3.17Å; S174-R176 PolarHBondContact O-N 3.47Å; S174-R176 VanDerWaalsContact O-N 3.14Å
177	H	49.8	Very low	52.6	Low	104 Å²	104	102.2 Å²	102.2	48%	0.481	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-87.1	-5.8	-176	-118.9	-68.7	0	0	0	114.7	L173 S174 D179 F180	L173-H177 PolarHBondContact O-N 2.86Å; S174-H177 WeakPolarHBondContact O-CB 3.5Å; S174-H177 PolarHBondContact O-N 3.33Å; H177-D179 VanDerWaalsContact C-N 3.25Å; H177-D179 PolarHBondContact O-N 3.16Å; H177-F180 AromaticContact CE1-CD1 3.76Å; H177-F180 AromaticContact CE1-CG 3.63Å; H177-F180 AromaticContact ND1-CG 3.81Å
178	G	50.8	Low	52.7	Low	81 Å²	81	102.3 Å²	102.3	84%	0.835	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-66.9	-15	-175.9	0	0	0	0	0	116.3
179	D	52.6	Low	52.7	Low	161 Å²	161	101.5 Å²	101.5	86%	0.861	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-130.4	23.1	-175.2	-144	-2	0	0	0	112.3	H177 N181	H177-D179 VanDerWaalsContact C-N 3.25Å; H177-D179 PolarHBondContact O-N 3.16Å; D179-N181 PolarHBondContact O-N 2.71Å
180	F	49.2	Very low	53	Low	51 Å²	51	101.4 Å²	101.4	22%	0.224	53%	0.531	C	S	.	.			trans	-91.2	105.6	-163	-160.6	-81.5	0	0	0	113.6	H177 V182 D185 I189	H177-F180 AromaticContact CE1-CD1 3.76Å; H177-F180 AromaticContact CE1-CG 3.63Å; H177-F180 AromaticContact ND1-CG 3.81Å; F180-V182 PolarHBondContact O-N 3.28Å; F180-D185 HydrophobicContact CD1-CB 4.39Å; F180-D185 HydrophobicContact CE1-CB 3.62Å; F180-D185 HydrophobicContact CE2-CB 4.04Å; F180-D185 HydrophobicContact CZ-CB 3.42Å; F180-D185 VanDerWaalsContact CZ-CB 3.42Å; F180-I189 HydrophobicContact CE1-CD1 3.82Å; F180-I189 HydrophobicContact CE1-CG1 3.5Å; F180-I189 VanDerWaalsContact CE1-CG1 3.5Å; F180-I189 HydrophobicContact CZ-CD1 4.49Å; F180-I189 HydrophobicContact CZ-CG1 3.68Å
181	N	54.8	Low	53.6	Low	70 Å²	70	105.9 Å²	105.9	37%	0.374	54%	0.54	S	S	.	.			trans	-85.8	96.3	-178.8	-168.7	-44.4	0	0	0	111.9	D179 K183 R184 D185	D179-N181 PolarHBondContact O-N 2.71Å; N181-K183 PolarHBondContact O-N 2.97Å; N181-K183 PolarHBondContact OD1-N 3.49Å; N181-K183 VanDerWaalsContact OD1-N 3.16Å; N181-R184 HydrophobicContact CB-CB 4.11Å; N181-R184 PolarHBondContact O-N 3.39Å; N181-R184 PolarHBondContact OD1-N 3Å; N181-D185 PolarHBondContact N-OD2 3.33Å; N181-D185 PolarHBondContact O-N 3.45Å
182	V	52.6	Low	53.9	Low	99 Å²	99	104.8 Å²	104.8	60%	0.6	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-28.6	-178.4	-179.2	0	0	0	0	114.5	F180 I189	F180-V182 PolarHBondContact O-N 3.28Å; V182-I189 HydrophobicContact CG1-CD1 4.21Å
183	K	53.4	Low	53.8	Low	197 Å²	197	107.5 Å²	107.5	86%	0.857	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-33.1	177.7	-66	-177	179.5	178.8	0	113.1	N181	N181-K183 PolarHBondContact O-N 2.97Å; N181-K183 PolarHBondContact OD1-N 3.49Å; N181-K183 VanDerWaalsContact OD1-N 3.16Å
184	R	56.8	Low	54.6	Low	193 Å²	193	108.5 Å²	108.5	73%	0.728	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-44.5	-179.8	-171.7	-178.9	-70	141.9	-5.5	111.4	N181 K186	N181-R184 HydrophobicContact CB-CB 4.11Å; N181-R184 PolarHBondContact O-N 3.39Å; N181-R184 PolarHBondContact OD1-N 3Å; R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.02Å
185	D	54.7	Low	54.6	Low	46 Å²	46	109.8 Å²	109.8	25%	0.246	55%	0.549	C	S	.	.	S	Bend	trans	-94.9	17	-166.5	-59.7	-65.7	0	0	0	114.1	F180 N181 A187 S188 I189	F180-D185 HydrophobicContact CD1-CB 4.39Å; F180-D185 HydrophobicContact CE1-CB 3.62Å; F180-D185 HydrophobicContact CE2-CB 4.04Å; F180-D185 HydrophobicContact CZ-CB 3.42Å; F180-D185 VanDerWaalsContact CZ-CB 3.42Å; N181-D185 PolarHBondContact N-OD2 3.33Å; N181-D185 PolarHBondContact O-N 3.45Å; D185-A187 PolarHBondContact O-N 3.32Å; D185-A187 VanDerWaalsContact O-N 3.14Å; D185-S188 WeakPolarHBondContact O-CA 3.41Å; D185-S188 VanDerWaalsContact O-CB 3.26Å; D185-S188 WeakPolarHBondContact O-CB 3.4Å; D185-S188 PolarHBondContact O-N 2.92Å; D185-I189 PolarHBondContact O-N 2.89Å
186	K	53.6	Low	54.8	Low	137 Å²	137	108 Å²	108	60%	0.596	55%	0.545	S	S	*	.	H	α-helix	trans	-54.2	-35	-177.2	-170.4	177.9	-178.5	-178.6	0	113.7	R184 I189 N190	R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.02Å; K186-I189 PolarHBondContact O-N 2.93Å; K186-N190 PolarHBondContact O-N 3.41Å
187	A	55.4	Low	55.2	Low	79 Å²	79	107.2 Å²	107.2	65%	0.653	55%	0.546	S	S	*	.	H	α-helix	trans	-66.3	-41.1	174	0	0	0	0	0	112.1	D185 N190 K191	D185-A187 PolarHBondContact O-N 3.32Å; D185-A187 VanDerWaalsContact O-N 3.14Å; A187-N190 PolarHBondContact O-N 3.06Å; A187-K191 WeakPolarHBondContact O-CB 3.34Å; A187-K191 PolarHBondContact O-N 2.83Å
188	S	56	Low	55.8	Low	60 Å²	60	106.1 Å²	106.1	42%	0.42	55%	0.547	S	S	.	.	H	α-helix	trans	-65.3	-41.6	175	-51.7	0	0	0	0	111.6	D185 N190 K191 M192	D185-S188 WeakPolarHBondContact O-CA 3.41Å; D185-S188 VanDerWaalsContact O-CB 3.26Å; D185-S188 WeakPolarHBondContact O-CB 3.4Å; D185-S188 PolarHBondContact O-N 2.92Å; S188-N190 PolarHBondContact O-N 3.29Å; S188-K191 PolarHBondContact O-N 3.41Å; S188-M192 VanDerWaalsContact O-CB 3.29Å; S188-M192 WeakPolarHBondContact O-CB 3.3Å; S188-M192 PolarHBondContact O-N 3.38Å
189	I	58.2	Low	56.1	Low	33 Å²	33	107 Å²	107	17%	0.169	53%	0.532	C	S	.	.	H	α-helix	trans	-58.2	-48.9	172.1	-54	173.7	0	0	0	110.3	F180 V182 D185 K186 K191 M192 R193	F180-I189 HydrophobicContact CE1-CD1 3.82Å; F180-I189 HydrophobicContact CE1-CG1 3.5Å; F180-I189 VanDerWaalsContact CE1-CG1 3.5Å; F180-I189 HydrophobicContact CZ-CD1 4.49Å; F180-I189 HydrophobicContact CZ-CG1 3.68Å; V182-I189 HydrophobicContact CG1-CD1 4.21Å; D185-I189 PolarHBondContact O-N 2.89Å; K186-I189 PolarHBondContact O-N 2.93Å; I189-K191 PolarHBondContact O-N 2.85Å; I189-M192 PolarHBondContact O-N 3.36Å; I189-R193 HydrophobicContact CG2-CG 4.27Å; I189-R193 WeakPolarHBondContact O-CB 3.41Å; I189-R193 WeakPolarHBondContact O-CG 3.49Å; I189-R193 PolarHBondContact O-N 3.03Å
190	N	62	Low	56.3	Low	88 Å²	88	104.7 Å²	104.7	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-38.9	-177.3	-75.1	-9.3	0	0	0	112.1	K186 A187 S188 R193 S194	K186-N190 PolarHBondContact O-N 3.41Å; A187-N190 PolarHBondContact O-N 3.06Å; S188-N190 PolarHBondContact O-N 3.29Å; N190-R193 PolarHBondContact O-N 2.87Å; N190-S194 WeakPolarHBondContact O-CB 3.28Å; N190-S194 PolarHBondContact O-N 3.49Å
191	K	62.4	Low	57.1	Low	150 Å²	150	110.4 Å²	110.4	65%	0.652	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-45.3	172.9	-169.5	173.8	-177.7	176.9	0	111.4	A187 S188 I189 S194 Q195	A187-K191 WeakPolarHBondContact O-CB 3.34Å; A187-K191 PolarHBondContact O-N 2.83Å; S188-K191 PolarHBondContact O-N 3.41Å; I189-K191 PolarHBondContact O-N 2.85Å; K191-S194 WeakPolarHBondContact O-CB 3.39Å; K191-S194 PolarHBondContact O-N 2.7Å; K191-Q195 WeakPolarHBondContact O-CG 3.28Å; K191-Q195 PolarHBondContact O-N 2.88Å
192	M	59.5	Low	57.3	Low	76 Å²	76	114.9 Å²	114.9	37%	0.374	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-41.9	177.2	-168	-173.3	-60.8	0	0	112.2	L173 S188 I189 S194 Q195 M196	L173-M192 HydrophobicContact CD2-CE 4.12Å; L173-M192 HydrophobicContact CD2-SD 4.07Å; S188-M192 VanDerWaalsContact O-CB 3.29Å; S188-M192 WeakPolarHBondContact O-CB 3.3Å; S188-M192 PolarHBondContact O-N 3.38Å; I189-M192 PolarHBondContact O-N 3.36Å; M192-S194 VanDerWaalsContact C-N 3.32Å; M192-S194 PolarHBondContact O-N 3.16Å; M192-Q195 PolarHBondContact O-N 3.43Å; M192-M196 WeakPolarHBondContact O-CB 3.22Å; M192-M196 PolarHBondContact O-N 3.36Å
193	R	50.1	Low	57.6	Low	167 Å²	167	113.3 Å²	113.3	63%	0.63	54%	0.541	S	S	*	.	H	α-helix	trans	-62.8	-36.5	173.2	-76.6	178.1	172	-179.7	-6	112.5	I189 N190 K197	I189-R193 HydrophobicContact CG2-CG 4.27Å; I189-R193 WeakPolarHBondContact O-CB 3.41Å; I189-R193 WeakPolarHBondContact O-CG 3.49Å; I189-R193 PolarHBondContact O-N 3.03Å; N190-R193 PolarHBondContact O-N 2.87Å; R193-K197 WeakPolarHBondContact O-CG 3.32Å; R193-K197 PolarHBondContact O-N 3.31Å
194	S	62.8	Low	57.7	Low	74 Å²	74	108.2 Å²	108.2	52%	0.517	52%	0.523	S	S	.	.	H	α-helix	trans	-63.3	-50.4	172.3	-172.5	0	0	0	0	111	N190 K191 M192 M196 K197 T198	N190-S194 WeakPolarHBondContact O-CB 3.28Å; N190-S194 PolarHBondContact O-N 3.49Å; K191-S194 WeakPolarHBondContact O-CB 3.39Å; K191-S194 PolarHBondContact O-N 2.7Å; M192-S194 VanDerWaalsContact C-N 3.32Å; M192-S194 PolarHBondContact O-N 3.16Å; S194-M196 VanDerWaalsContact C-N 3.31Å; S194-M196 PolarHBondContact O-N 2.93Å; S194-K197 PolarHBondContact O-N 3.42Å; S194-K197 VanDerWaalsContact O-N 3.13Å; S194-T198 PolarHBondContact O-N 2.95Å; S194-T198 PolarHBondContact O-OG1 3.37Å
195	Q	52	Low	57.7	Low	113 Å²	113	103.4 Å²	103.4	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-39.7	176.4	-68.4	176.8	-94.2	0	0	112.6	K191 M192 T198 L199	K191-Q195 WeakPolarHBondContact O-CG 3.28Å; K191-Q195 PolarHBondContact O-N 2.88Å; M192-Q195 PolarHBondContact O-N 3.43Å; Q195-T198 PolarHBondContact O-N 3.44Å; Q195-L199 WeakPolarHBondContact O-CG 3.36Å; Q195-L199 PolarHBondContact O-N 3.23Å
196	M	56.5	Low	57.6	Low	113 Å²	113	106.2 Å²	106.2	56%	0.557	52%	0.523	S	S	*	.	H	α-helix	trans	-63.9	-41.6	175.5	-164	69.1	170.6	0	0	111.9	M192 S194 L199 L200	M192-M196 WeakPolarHBondContact O-CB 3.22Å; M192-M196 PolarHBondContact O-N 3.36Å; S194-M196 VanDerWaalsContact C-N 3.31Å; S194-M196 PolarHBondContact O-N 2.93Å; M196-L199 PolarHBondContact O-N 3.17Å; M196-L200 HydrophobicContact CG-CD1 4.34Å; M196-L200 WeakPolarHBondContact O-CB 3.32Å; M196-L200 PolarHBondContact O-N 3.14Å
197	K	56.7	Low	57.6	Low	160 Å²	160	105.4 Å²	105.4	70%	0.696	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-36.4	173.3	-76.9	-168.6	173.4	-164.3	0	112.5	R193 S194 R201	R193-K197 WeakPolarHBondContact O-CG 3.32Å; R193-K197 PolarHBondContact O-N 3.31Å; S194-K197 PolarHBondContact O-N 3.42Å; S194-K197 VanDerWaalsContact O-N 3.13Å; K197-R201 WeakPolarHBondContact O-CB 3.48Å; K197-R201 PolarHBondContact O-N 3.47Å
198	T	61.1	Low	57.3	Low	81 Å²	81	107.7 Å²	107.7	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-66.2	-39.2	173.3	-53.7	0	0	0	0	112.1	S194 Q195 R202	S194-T198 PolarHBondContact O-N 2.95Å; S194-T198 PolarHBondContact O-OG1 3.37Å; Q195-T198 PolarHBondContact O-N 3.44Å; T198-R202 PolarHBondContact O-N 2.94Å
199	L	56.9	Low	56.9	Low	100 Å²	100	110.8 Å²	110.8	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-49.2	175.4	-78.5	164.2	0	0	0	111.7	Q195 M196 R201 R202 V203	Q195-L199 WeakPolarHBondContact O-CG 3.36Å; Q195-L199 PolarHBondContact O-N 3.23Å; M196-L199 PolarHBondContact O-N 3.17Å; L199-R201 VanDerWaalsContact C-N 3.31Å; L199-R201 PolarHBondContact O-N 3.17Å; L199-R202 PolarHBondContact O-N 3.31Å; L199-R202 VanDerWaalsContact O-N 3.08Å; L199-V203 WeakPolarHBondContact O-CG2 3.34Å; L199-V203 PolarHBondContact O-N 3.44Å
200	L	58.1	Low	56.4	Low	112 Å²	112	114.1 Å²	114.1	59%	0.586	55%	0.546	S	S	*	.	H	α-helix	trans	-56.9	-43.8	175.7	-81.5	159.8	0	0	0	112	M196 R202 V203 N204	M196-L200 HydrophobicContact CG-CD1 4.34Å; M196-L200 WeakPolarHBondContact O-CB 3.32Å; M196-L200 PolarHBondContact O-N 3.14Å; L200-R202 PolarHBondContact O-N 2.59Å; L200-V203 PolarHBondContact O-N 2.95Å; L200-N204 PolarHBondContact O-N 3.44Å; L200-N204 VanDerWaalsContact O-N 3.07Å
201	R	66.1	Low	55.7	Low	171 Å²	171	113.7 Å²	113.7	65%	0.645	56%	0.555	S	S	*	*	H	α-helix	trans	-60.3	-44.2	174.6	-169.3	-175.2	-68	-177.7	-4.8	111.6	K197 L199 V203 N204 E205	K197-R201 WeakPolarHBondContact O-CB 3.48Å; K197-R201 PolarHBondContact O-N 3.47Å; L199-R201 VanDerWaalsContact C-N 3.31Å; L199-R201 PolarHBondContact O-N 3.17Å; R201-V203 PolarHBondContact O-N 3.37Å; R201-N204 PolarHBondContact O-N 3.22Å; R201-E205 VanDerWaalsContact CD-OE1 3.29Å; R201-E205 WeakPolarHBondContact CD-OE1 3.38Å; R201-E205 HydrophobicContact CG-CG 4.32Å; R201-E205 VanDerWaalsContact CG-OE1 3.29Å; R201-E205 WeakPolarHBondContact CG-OE1 3.12Å; R201-E205 WeakPolarHBondContact O-CB 3.35Å; R201-E205 VanDerWaalsContact O-CG 3.26Å; R201-E205 WeakPolarHBondContact O-CG 2.82Å; R201-E205 PolarHBondContact O-N 3.42Å
202	R	59.4	Low	55.1	Low	164 Å²	164	113.3 Å²	113.3	62%	0.619	56%	0.56	S	S	*	*	H	α-helix	trans	-66.7	-33.1	177.4	-83.8	-168.1	170.5	-163.1	-1.9	114	T198 L199 L200 I206	T198-R202 PolarHBondContact O-N 2.94Å; L199-R202 PolarHBondContact O-N 3.31Å; L199-R202 VanDerWaalsContact O-N 3.08Å; L200-R202 PolarHBondContact O-N 2.59Å; R202-I206 WeakPolarHBondContact O-CB 3.4Å; R202-I206 WeakPolarHBondContact O-CD1 3.23Å; R202-I206 WeakPolarHBondContact O-CG1 3.34Å; R202-I206 PolarHBondContact O-N 3.41Å
203	V	57.8	Low	55.1	Low	65 Å²	65	112.9 Å²	112.9	39%	0.394	57%	0.574	S	S	.	*	H	α-helix	trans	-64.1	-48.6	172.9	173.1	0	0	0	0	109.7	L199 L200 R201 E205 I206 E207	L199-V203 WeakPolarHBondContact O-CG2 3.34Å; L199-V203 PolarHBondContact O-N 3.44Å; L200-V203 PolarHBondContact O-N 2.95Å; R201-V203 PolarHBondContact O-N 3.37Å; V203-E205 PolarHBondContact O-N 3.42Å; V203-I206 CarbonylContact O-C 3.57Å; V203-I206 WeakPolarHBondContact O-CA 3.37Å; V203-I206 WeakPolarHBondContact O-CB 3.42Å; V203-I206 PolarHBondContact O-N 2.93Å; V203-E207 HydrophobicContact CG1-CG 4.49Å; V203-E207 WeakPolarHBondContact O-CG 3.46Å; V203-E207 PolarHBondContact O-N 3.05Å
204	N	56.5	Low	55.3	Low	90 Å²	90	109 Å²	109	48%	0.481	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-40	175.9	-173.4	100.5	0	0	0	112.7	L200 R201 I206 E207 Q208	L200-N204 PolarHBondContact O-N 3.44Å; L200-N204 VanDerWaalsContact O-N 3.07Å; R201-N204 PolarHBondContact O-N 3.22Å; N204-I206 VanDerWaalsContact C-N 3.28Å; N204-I206 PolarHBondContact O-N 3.5Å; N204-E207 PolarHBondContact O-N 2.87Å; N204-Q208 WeakPolarHBondContact O-CB 3.33Å; N204-Q208 WeakPolarHBondContact O-CG 3.14Å; N204-Q208 PolarHBondContact O-N 2.87Å
205	E	55.3	Low	55	Low	93 Å²	93	110.3 Å²	110.3	44%	0.435	57%	0.571	S	S	.	*	H	α-helix	trans	-61.8	-33.8	172.3	-74	165	-174.9	0	0	112.1	R201 V203 K209	R201-E205 VanDerWaalsContact CD-OE1 3.29Å; R201-E205 WeakPolarHBondContact CD-OE1 3.38Å; R201-E205 HydrophobicContact CG-CG 4.32Å; R201-E205 VanDerWaalsContact CG-OE1 3.29Å; R201-E205 WeakPolarHBondContact CG-OE1 3.12Å; R201-E205 WeakPolarHBondContact O-CB 3.35Å; R201-E205 VanDerWaalsContact O-CG 3.26Å; R201-E205 WeakPolarHBondContact O-CG 2.82Å; R201-E205 PolarHBondContact O-N 3.42Å; V203-E205 PolarHBondContact O-N 3.42Å; E205-K209 WeakPolarHBondContact O-CB 3.38Å; E205-K209 WeakPolarHBondContact O-CG 3.47Å; E205-K209 PolarHBondContact O-N 2.93Å; E205-K209 VanDerWaalsContact O-N 3.09Å
206	I	53.7	Low	54.9	Low	105 Å²	105	112.8 Å²	112.8	54%	0.538	58%	0.58	S	S	.	*	H	α-helix	trans	-74.5	-43.4	175.2	-73	164.2	0	0	0	110.7	R202 V203 N204 Q208 K209 V210	R202-I206 WeakPolarHBondContact O-CB 3.4Å; R202-I206 WeakPolarHBondContact O-CD1 3.23Å; R202-I206 WeakPolarHBondContact O-CG1 3.34Å; R202-I206 PolarHBondContact O-N 3.41Å; V203-I206 CarbonylContact O-C 3.57Å; V203-I206 WeakPolarHBondContact O-CA 3.37Å; V203-I206 WeakPolarHBondContact O-CB 3.42Å; V203-I206 PolarHBondContact O-N 2.93Å; N204-I206 VanDerWaalsContact C-N 3.28Å; N204-I206 PolarHBondContact O-N 3.5Å; I206-Q208 PolarHBondContact O-N 2.73Å; I206-K209 CarbonylContact O-C 3.55Å; I206-K209 PolarHBondContact O-N 3.2Å; I206-K209 VanDerWaalsContact O-N 3.12Å; I206-V210 HydrophobicContact CG2-CG2 4.18Å; I206-V210 WeakPolarHBondContact O-CB 3.39Å; I206-V210 VanDerWaalsContact O-CG2 3.28Å; I206-V210 WeakPolarHBondContact O-CG2 3.29Å; I206-V210 PolarHBondContact O-N 2.97Å
207	E	53.8	Low	54.6	Low	120 Å²	120	110 Å²	110	56%	0.561	57%	0.569	S	S	*	*	H	α-helix	trans	-60.8	-44.5	176.7	-71.6	167.1	152.2	0	0	111.2	V203 N204 K209 V210 A211	V203-E207 HydrophobicContact CG1-CG 4.49Å; V203-E207 WeakPolarHBondContact O-CG 3.46Å; V203-E207 PolarHBondContact O-N 3.05Å; N204-E207 PolarHBondContact O-N 2.87Å; E207-K209 VanDerWaalsContact C-N 3.33Å; E207-K209 PolarHBondContact O-N 3.14Å; E207-V210 PolarHBondContact O-N 3.2Å; E207-A211 PolarHBondContact O-N 3.05Å
208	Q	49	Very low	54.7	Low	126 Å²	126	106.3 Å²	106.3	59%	0.589	56%	0.555	S	S	*	*	H	α-helix	trans	-64.5	-32.1	173.2	-68.3	-69.6	-30	0	0	113	N204 I206	N204-Q208 WeakPolarHBondContact O-CB 3.33Å; N204-Q208 WeakPolarHBondContact O-CG 3.14Å; N204-Q208 PolarHBondContact O-N 2.87Å; I206-Q208 PolarHBondContact O-N 2.73Å
209	K	46.3	Very low	54.5	Low	126 Å²	126	106.6 Å²	106.6	55%	0.548	56%	0.556	S	S	.	*	H	α-helix	trans	-78.9	-29.7	173.6	-82.3	-173.4	167.2	-167.2	0	113.7	E205 I206 E207 A211 N212 G213 E218	E205-K209 WeakPolarHBondContact O-CB 3.38Å; E205-K209 WeakPolarHBondContact O-CG 3.47Å; E205-K209 PolarHBondContact O-N 2.93Å; E205-K209 VanDerWaalsContact O-N 3.09Å; I206-K209 CarbonylContact O-C 3.55Å; I206-K209 PolarHBondContact O-N 3.2Å; I206-K209 VanDerWaalsContact O-N 3.12Å; E207-K209 VanDerWaalsContact C-N 3.33Å; E207-K209 PolarHBondContact O-N 3.14Å; K209-A211 VanDerWaalsContact C-N 3.25Å; K209-A211 PolarHBondContact O-N 3.03Å; K209-N212 PolarHBondContact O-N 3.49Å; K209-G213 PolarHBondContact O-N 2.96Å; K209-E218 IonicContact NZ-OE1 2.6Å; K209-E218 PolarHBondContact NZ-OE1 2.87Å
210	V	48.3	Very low	54.6	Low	103 Å²	103	108.5 Å²	108.5	62%	0.624	56%	0.556	S	S	*	*	H	α-helix	trans	-65.3	-31.7	175.7	163.3	0	0	0	0	110.9	I206 E207 N212	I206-V210 HydrophobicContact CG2-CG2 4.18Å; I206-V210 WeakPolarHBondContact O-CB 3.39Å; I206-V210 VanDerWaalsContact O-CG2 3.28Å; I206-V210 WeakPolarHBondContact O-CG2 3.29Å; I206-V210 PolarHBondContact O-N 2.97Å; E207-V210 PolarHBondContact O-N 3.2Å; V210-N212 PolarHBondContact O-N 2.88Å
211	A	48.2	Very low	54.9	Low	79 Å²	79	108.6 Å²	108.6	65%	0.653	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-26.6	169.6	0	0	0	0	0	113.8	E207 K209	E207-A211 PolarHBondContact O-N 3.05Å; K209-A211 VanDerWaalsContact C-N 3.25Å; K209-A211 PolarHBondContact O-N 3.03Å
212	N	49.5	Very low	54.8	Low	142 Å²	142	105.7 Å²	105.7	76%	0.759	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	4.3	-171	-68.2	-7.9	0	0	0	115.1	K209 V210 D214	K209-N212 PolarHBondContact O-N 3.49Å; V210-N212 PolarHBondContact O-N 2.88Å; N212-D214 PolarHBondContact O-N 2.92Å
213	G	58.3	Low	55	Low	66 Å²	66	103.5 Å²	103.5	68%	0.68	55%	0.55	S	S	*	*			trans	82.4	0.1	144.5	0	0	0	0	0	122.1	K209	K209-G213 PolarHBondContact O-N 2.96Å
214	D	54.2	Low	55.5	Low	86 Å²	86	105.7 Å²	105.7	46%	0.46	56%	0.56	S	S	.	*			trans	-116	81.3	171.7	-171.9	18.1	0	0	0	115	N212 K216 T217	N212-D214 PolarHBondContact O-N 2.92Å; D214-K216 PolarHBondContact O-N 3.48Å; D214-K216 WeakPolarHBondContact OD1-CA 3.42Å; D214-K216 VanDerWaalsContact OD1-CB 3.24Å; D214-K216 WeakPolarHBondContact OD1-CB 3.43Å; D214-K216 PolarHBondContact OD1-N 2.9Å; D214-T217 PolarHBondContact OD1-N 3.28Å; D214-T217 WeakPolarHBondContact OD2-CB 3.41Å; D214-T217 PolarHBondContact OD2-OG1 3.3Å
215	V	56.3	Low	56.2	Low	102 Å²	102	104.8 Å²	104.8	62%	0.618	56%	0.557	S	S	*	*	H	α-helix	trans	-68.7	-22.7	169.7	-179.3	0	0	0	0	112.2	T217 V219	V215-T217 PolarHBondContact O-N 3.43Å; V215-V219 HydrophobicContact CG1-CG2 3.99Å; V215-V219 VanDerWaalsContact O-CG2 3.31Å; V215-V219 WeakPolarHBondContact O-CG2 3.36Å; V215-V219 PolarHBondContact O-N 2.84Å
216	K	51.8	Low	56.7	Low	165 Å²	165	105.7 Å²	105.7	72%	0.717	57%	0.565	S	S	*	*	H	α-helix	trans	-78.2	-19.7	-165.2	-158.2	178.8	-175.6	178.7	0	113.2	D214 R220	D214-K216 PolarHBondContact O-N 3.48Å; D214-K216 WeakPolarHBondContact OD1-CA 3.42Å; D214-K216 VanDerWaalsContact OD1-CB 3.24Å; D214-K216 WeakPolarHBondContact OD1-CB 3.43Å; D214-K216 PolarHBondContact OD1-N 2.9Å; K216-R220 PolarHBondContact O-NE 3.33Å; K216-R220 PolarHBondContact O-NH2 3.49Å
217	T	49.9	Very low	57.2	Low	53 Å²	53	105.4 Å²	105.4	33%	0.325	56%	0.564	S	S	.	*	H	α-helix	trans	-92.8	-45.6	179.6	-59.8	0	0	0	0	111.7	D214 V215 V219 R220 Q221	D214-T217 PolarHBondContact OD1-N 3.28Å; D214-T217 WeakPolarHBondContact OD2-CB 3.41Å; D214-T217 PolarHBondContact OD2-OG1 3.3Å; V215-T217 PolarHBondContact O-N 3.43Å; T217-V219 PolarHBondContact O-N 2.98Å; T217-R220 WeakPolarHBondContact O-CA 3.29Å; T217-R220 VanDerWaalsContact O-CB 3.28Å; T217-R220 WeakPolarHBondContact O-CB 3.22Å; T217-R220 PolarHBondContact O-N 3.43Å; T217-R220 PolarHBondContact OG1-NH2 2.89Å; T217-Q221 PolarHBondContact O-N 2.84Å; T217-Q221 VanDerWaalsContact O-N 3.08Å
218	E	58.1	Low	57.9	Low	84 Å²	84	104.6 Å²	104.6	39%	0.393	56%	0.56	S	S	.	*	H	α-helix	trans	-56.7	-45.7	175	-71.5	-85.5	-153.9	0	0	112.2	K209 R220 Q221 L222	K209-E218 IonicContact NZ-OE1 2.6Å; K209-E218 PolarHBondContact NZ-OE1 2.87Å; E218-R220 PolarHBondContact O-N 3.28Å; E218-Q221 PolarHBondContact O-N 3.3Å; E218-L222 WeakPolarHBondContact O-CB 3.19Å; E218-L222 PolarHBondContact O-N 2.79Å
219	V	57.8	Low	58.2	Low	86 Å²	86	104 Å²	104	52%	0.521	56%	0.559	S	S	.	*	H	α-helix	trans	-59	-32.5	176.1	170.3	0	0	0	0	112.1	V215 T217 L223	V215-V219 HydrophobicContact CG1-CG2 3.99Å; V215-V219 VanDerWaalsContact O-CG2 3.31Å; V215-V219 WeakPolarHBondContact O-CG2 3.36Å; V215-V219 PolarHBondContact O-N 2.84Å; T217-V219 PolarHBondContact O-N 2.98Å; V219-L223 WeakPolarHBondContact O-CB 3.49Å; V219-L223 PolarHBondContact O-N 3.04Å
220	R	58.8	Low	58.6	Low	140 Å²	140	102.5 Å²	102.5	53%	0.528	55%	0.553	S	S	.	*	H	α-helix	trans	-74.4	-40.9	178.9	-127	176.4	-55.3	147.7	15.8	111.8	K216 T217 E218 L223 N224	K216-R220 PolarHBondContact O-NE 3.33Å; K216-R220 PolarHBondContact O-NH2 3.49Å; T217-R220 WeakPolarHBondContact O-CA 3.29Å; T217-R220 VanDerWaalsContact O-CB 3.28Å; T217-R220 WeakPolarHBondContact O-CB 3.22Å; T217-R220 PolarHBondContact O-N 3.43Å; T217-R220 PolarHBondContact OG1-NH2 2.89Å; E218-R220 PolarHBondContact O-N 3.28Å; R220-L223 PolarHBondContact O-N 3.2Å; R220-N224 PolarHBondContact O-N 3.11Å; R220-N224 VanDerWaalsContact O-N 3.09Å
221	Q	63.6	Low	59.1	Low	115 Å²	115	104 Å²	104	54%	0.537	55%	0.55	S	S	.	*	H	α-helix	trans	-68.2	-40	174.8	-74.6	174.5	-58.5	0	0	111.2	T217 E218 L223 N224 T225	T217-Q221 PolarHBondContact O-N 2.84Å; T217-Q221 VanDerWaalsContact O-N 3.08Å; E218-Q221 PolarHBondContact O-N 3.3Å; Q221-L223 PolarHBondContact O-N 2.79Å; Q221-N224 PolarHBondContact O-N 3.34Å; Q221-T225 WeakPolarHBondContact O-CB 3.32Å; Q221-T225 PolarHBondContact O-N 3.37Å; Q221-T225 PolarHBondContact O-OG1 3.46Å
222	L	64.3	Low	59.2	Low	110 Å²	110	104.5 Å²	104.5	58%	0.576	56%	0.555	S	S	*	*	H	α-helix	trans	-58.9	-45.1	171.7	-86.1	163.3	0	0	0	112.1	E218 T225 L226	E218-L222 WeakPolarHBondContact O-CB 3.19Å; E218-L222 PolarHBondContact O-N 2.79Å; L222-T225 PolarHBondContact O-N 2.93Å; L222-L226 WeakPolarHBondContact O-CB 3.4Å; L222-L226 PolarHBondContact O-N 3.35Å
223	L	63.4	Low	59.1	Low	117 Å²	117	104.9 Å²	104.9	61%	0.613	56%	0.556	S	S	*	*	H	α-helix	trans	-63.9	-43.8	179.1	-159.7	74.7	0	0	0	112.3	V219 R220 Q221 L226 N227	V219-L223 WeakPolarHBondContact O-CB 3.49Å; V219-L223 PolarHBondContact O-N 3.04Å; R220-L223 PolarHBondContact O-N 3.2Å; Q221-L223 PolarHBondContact O-N 2.79Å; L223-L226 PolarHBondContact O-N 2.88Å; L223-N227 PolarHBondContact O-N 2.88Å
224	N	69.1	Low	58.5	Low	112 Å²	112	104.1 Å²	104.1	60%	0.599	55%	0.549	S	S	*	.	H	α-helix	trans	-63.6	-41	174.1	-80.2	0.9	0	0	0	112.1	R220 Q221 N227 E228	R220-N224 PolarHBondContact O-N 3.11Å; R220-N224 VanDerWaalsContact O-N 3.09Å; Q221-N224 PolarHBondContact O-N 3.34Å; N224-N227 PolarHBondContact O-N 2.92Å; N224-E228 PolarHBondContact O-N 2.93Å
225	T	69.9	Low	58.1	Low	70 Å²	70	107 Å²	107	43%	0.429	56%	0.559	S	S	.	*	H	α-helix	trans	-64.3	-42.5	178.1	-56.4	0	0	0	0	111.1	Q221 L222 N227 M229	Q221-T225 WeakPolarHBondContact O-CB 3.32Å; Q221-T225 PolarHBondContact O-N 3.37Å; Q221-T225 PolarHBondContact O-OG1 3.46Å; L222-T225 PolarHBondContact O-N 2.93Å; T225-N227 VanDerWaalsContact C-N 3.3Å; T225-N227 PolarHBondContact O-N 3.33Å; T225-M229 HydrophobicContact CG2-CE 3.86Å; T225-M229 HydrophobicContact CG2-CG 4.47Å; T225-M229 HydrophobicContact CG2-SD 4.18Å; T225-M229 VanDerWaalsContact O-CB 3.29Å; T225-M229 WeakPolarHBondContact O-CB 3.41Å; T225-M229 VanDerWaalsContact O-CG 3.26Å; T225-M229 WeakPolarHBondContact O-CG 3.48Å; T225-M229 PolarHBondContact O-N 3.3Å
226	L	66.3	Low	57.2	Low	113 Å²	113	104.6 Å²	104.6	59%	0.592	56%	0.556	S	S	*	*	H	α-helix	trans	-59.3	-40.6	173	-107.3	166	0	0	0	112	L222 L223 K230	L222-L226 WeakPolarHBondContact O-CB 3.4Å; L222-L226 PolarHBondContact O-N 3.35Å; L223-L226 PolarHBondContact O-N 2.88Å; L226-K230 WeakPolarHBondContact O-CB 3.3Å; L226-K230 PolarHBondContact O-N 3.49Å
227	N	64.3	Low	57.5	Low	98 Å²	98	104.2 Å²	104.2	52%	0.524	57%	0.566	S	S	.	*	H	α-helix	trans	-73.6	-39.7	-177.1	-154.3	35.1	0	0	0	112.5	L223 N224 T225 K230 K231	L223-N227 PolarHBondContact O-N 2.88Å; N224-N227 PolarHBondContact O-N 2.92Å; T225-N227 VanDerWaalsContact C-N 3.3Å; T225-N227 PolarHBondContact O-N 3.33Å; N227-K230 WeakPolarHBondContact O-CB 3.11Å; N227-K230 PolarHBondContact O-N 3.09Å; N227-K231 VanDerWaalsContact O-CB 3.32Å; N227-K231 WeakPolarHBondContact O-CB 3.48Å; N227-K231 PolarHBondContact O-N 3.43Å
228	E	67.5	Low	57	Low	103 Å²	103	106.6 Å²	106.6	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-72	-34.3	172.8	-70.8	-61.5	134.8	0	0	112.1	N224 K231 A232	N224-E228 PolarHBondContact O-N 2.93Å; E228-K231 PolarHBondContact O-N 2.73Å; E228-K231 IonicContact OE1-NZ 3.61Å; E228-K231 PolarHBondContact OE1-NZ 3.03Å; E228-K231 IonicContact OE2-NZ 2.66Å; E228-K231 PolarHBondContact OE2-NZ 2.89Å; E228-A232 WeakPolarHBondContact O-CB 3.26Å; E228-A232 PolarHBondContact O-N 3.49Å
229	M	55.8	Low	56.7	Low	115 Å²	115	112.5 Å²	112.5	57%	0.567	61%	0.607	S	S	*	*	H	α-helix	trans	-62.4	-43.8	168.9	-77.2	-177.9	175.8	0	0	111.6	T225 K231 A232 L233	T225-M229 HydrophobicContact CG2-CE 3.86Å; T225-M229 HydrophobicContact CG2-CG 4.47Å; T225-M229 HydrophobicContact CG2-SD 4.18Å; T225-M229 VanDerWaalsContact O-CB 3.29Å; T225-M229 WeakPolarHBondContact O-CB 3.41Å; T225-M229 VanDerWaalsContact O-CG 3.26Å; T225-M229 WeakPolarHBondContact O-CG 3.48Å; T225-M229 PolarHBondContact O-N 3.3Å; M229-K231 VanDerWaalsContact C-N 3.29Å; M229-K231 PolarHBondContact O-N 3.42Å; M229-A232 PolarHBondContact O-N 3.33Å; M229-L233 VanDerWaalsContact O-CB 3.29Å; M229-L233 WeakPolarHBondContact O-CB 3.47Å; M229-L233 VanDerWaalsContact O-CG 3.22Å; M229-L233 WeakPolarHBondContact O-CG 3.43Å; M229-L233 PolarHBondContact O-N 3.48Å
230	K	56.1	Low	56.3	Low	94 Å²	94	114.3 Å²	114.3	41%	0.409	62%	0.624	S	S	.	*	H	α-helix	trans	-58.8	-39.7	176	178.1	173	-179.6	157	0	112.5	L226 N227 L233 G234 E235	L226-K230 WeakPolarHBondContact O-CB 3.3Å; L226-K230 PolarHBondContact O-N 3.49Å; N227-K230 WeakPolarHBondContact O-CB 3.11Å; N227-K230 PolarHBondContact O-N 3.09Å; K230-L233 PolarHBondContact O-N 2.81Å; K230-G234 PolarHBondContact O-N 3.34Å; K230-E235 HydrophobicContact CD-CB 4.48Å; K230-E235 VanDerWaalsContact CE-CD 3.49Å; K230-E235 WeakPolarHBondContact CE-OE2 3.43Å; K230-E235 HydrophobicContact CG-CB 3.89Å; K230-E235 IonicContact NZ-OE2 2.75Å; K230-E235 PolarHBondContact NZ-OE2 3.13Å; K230-E235 PolarHBondContact O-N 2.96Å
231	K	57.4	Low	55.5	Low	133 Å²	133	110.9 Å²	110.9	58%	0.578	63%	0.632	S	S	*	*	H	α-helix	trans	-71.7	-40.6	177.1	-177.6	176.3	161.9	-145.8	0	112.2	N227 E228 M229 L233 G234	N227-K231 VanDerWaalsContact O-CB 3.32Å; N227-K231 WeakPolarHBondContact O-CB 3.48Å; N227-K231 PolarHBondContact O-N 3.43Å; E228-K231 PolarHBondContact O-N 2.73Å; E228-K231 IonicContact OE1-NZ 3.61Å; E228-K231 PolarHBondContact OE1-NZ 3.03Å; E228-K231 IonicContact OE2-NZ 2.66Å; E228-K231 PolarHBondContact OE2-NZ 2.89Å; M229-K231 VanDerWaalsContact C-N 3.29Å; M229-K231 PolarHBondContact O-N 3.42Å; K231-L233 VanDerWaalsContact C-N 3.32Å; K231-G234 PolarHBondContact O-N 2.85Å; K231-G234 VanDerWaalsContact O-N 3.16Å
232	A	50.2	Low	54.5	Low	91 Å²	91	117.8 Å²	117.8	75%	0.752	65%	0.653	S	S	*	*	H	α-helix	trans	-68.7	-28.4	172.4	0	0	0	0	0	113.2	E228 M229 G234	E228-A232 WeakPolarHBondContact O-CB 3.26Å; E228-A232 PolarHBondContact O-N 3.49Å; M229-A232 PolarHBondContact O-N 3.33Å; A232-G234 PolarHBondContact O-N 2.95Å
233	L	47.8	Very low	53.7	Low	150 Å²	150	116.5 Å²	116.5	79%	0.785	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	0.7	171.5	-71.9	166.8	0	0	0	113.5	M229 K230 K231	M229-L233 VanDerWaalsContact O-CB 3.29Å; M229-L233 WeakPolarHBondContact O-CB 3.47Å; M229-L233 VanDerWaalsContact O-CG 3.22Å; M229-L233 WeakPolarHBondContact O-CG 3.43Å; M229-L233 PolarHBondContact O-N 3.48Å; K230-L233 PolarHBondContact O-N 2.81Å; K231-L233 VanDerWaalsContact C-N 3.32Å
234	G	46.3	Very low	52.8	Low	50 Å²	50	118.9 Å²	118.9	52%	0.515	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	87.6	15	167.9	0	0	0	0	0	116.5	K230 K231 A232 G236	K230-G234 PolarHBondContact O-N 3.34Å; K231-G234 PolarHBondContact O-N 2.85Å; K231-G234 VanDerWaalsContact O-N 3.16Å; A232-G234 PolarHBondContact O-N 2.95Å; G234-G236 PolarHBondContact O-N 3.28Å
235	E	44.5	Very low	51.3	Low	145 Å²	145	117.1 Å²	117.1	68%	0.678	66%	0.657	S	S	*	*			trans	-76.4	58.2	170	-88.3	-164.5	-136.4	0	0	112.7	K230	K230-E235 HydrophobicContact CD-CB 4.48Å; K230-E235 VanDerWaalsContact CE-CD 3.49Å; K230-E235 WeakPolarHBondContact CE-OE2 3.43Å; K230-E235 HydrophobicContact CG-CB 3.89Å; K230-E235 IonicContact NZ-OE2 2.75Å; K230-E235 PolarHBondContact NZ-OE2 3.13Å; K230-E235 PolarHBondContact O-N 2.96Å
236	G	39.3	Very low	50.2	Low	53 Å²	53	117.4 Å²	117.4	55%	0.546	66%	0.662	S	S	.	*	S	Bend	trans	-112.1	127.7	153.2	0	0	0	0	0	108.4	G234 P238	G234-G236 PolarHBondContact O-N 3.28Å; G236-P238 WeakPolarHBondContact O-CD 3.26Å
237	V	56.5	Low	49.4	Very low	156 Å²	156	116.3 Å²	116.3	95%	0.945	66%	0.659	S	S	*	*			trans	-54.5	120.6	-170.6	175.9	0	0	0	0	112.8
238	P	39.9	Very low	48.7	Very low	103 Å²	103	115.2 Å²	115.2	67%	0.669	66%	0.659	S	S	*	*			trans	-112.4	137.1	168.6	23.8	-4.1	0	0	0	112.2	G236	G236-P238 WeakPolarHBondContact O-CD 3.26Å
239	K	52.4	Low	48.9	Very low	208 Å²	208	114.2 Å²	114.2	90%	0.904	65%	0.653	S	S	*	*	S	Bend	trans	-73.8	156	150.8	-71.2	178.1	176.6	177	0	108.6
240	S	48.4	Very low	49.9	Very low	125 Å²	125	114 Å²	114	87%	0.874	65%	0.653	S	S	*	*			trans	77.9	136.9	173.2	-155.6	0	0	0	0	115.6
241	G	43.1	Very low	51.2	Low	68 Å²	68	109.9 Å²	109.9	70%	0.701	64%	0.635	S	S	*	*			trans	-141.8	-164.5	-176.6	0	0	0	0	0	113.2
242	R	41.7	Very low	52.6	Low	259 Å²	259	107.5 Å²	107.5	98%	0.977	63%	0.632	S	S	*	*			trans	-135.7	151.7	160.2	-80.7	-169.6	-178	-166.9	1.1	110
243	S	48.7	Very low	54.5	Low	84 Å²	84	103.2 Å²	103.2	59%	0.587	60%	0.596	S	S	*	*			trans	-95	129.2	-159.2	-168.7	0	0	0	0	114	N245	S243-N245 VanDerWaalsContact OG-CA 3.29Å; S243-N245 WeakPolarHBondContact OG-CA 3.29Å; S243-N245 WeakPolarHBondContact OG-CB 3.43Å; S243-N245 PolarHBondContact OG-N 3.16Å; S243-N245 PolarHBondContact OG-OD1 2.94Å
244	L	43	Very low	56.6	Low	166 Å²	166	99.5 Å²	99.5	87%	0.869	58%	0.58	S	S	*	*			trans	-122.5	42.1	134.9	-157.8	78.1	0	0	0	111.4	S246	L244-S246 VanDerWaalsContact C-N 3.29Å; L244-S246 PolarHBondContact O-N 2.94Å
245	N	38.7	Very low	58.8	Low	76 Å²	76	99.6 Å²	99.6	41%	0.406	57%	0.568	S	S	.	*			trans	59.9	-34.1	144.1	-113.5	-1.4	0	0	0	121.9	K11 S243 T247	K11-N245 HydrophobicContact CB-CB 4.36Å; K11-N245 HydrophobicContact CD-CB 3.66Å; K11-N245 VanDerWaalsContact CD-O 3.27Å; K11-N245 WeakPolarHBondContact CD-O 3.41Å; K11-N245 WeakPolarHBondContact CD-OD1 3.26Å; K11-N245 WeakPolarHBondContact CE-O 3.45Å; K11-N245 PolarHBondContact NZ-O 3.46Å; K11-N245 PolarHBondContact NZ-OD1 3.24Å; S243-N245 VanDerWaalsContact OG-CA 3.29Å; S243-N245 WeakPolarHBondContact OG-CA 3.29Å; S243-N245 WeakPolarHBondContact OG-CB 3.43Å; S243-N245 PolarHBondContact OG-N 3.16Å; S243-N245 PolarHBondContact OG-OD1 2.94Å; N245-T247 VanDerWaalsContact C-N 3.28Å; N245-T247 PolarHBondContact O-N 2.89Å
246	S	47	Very low	61	Low	76 Å²	76	95.8 Å²	95.8	53%	0.531	55%	0.55	S	S	.	.			trans	-71.3	76.6	-176.3	-62.2	0	0	0	0	112.6	L244 C248	L244-S246 VanDerWaalsContact C-N 3.29Å; L244-S246 PolarHBondContact O-N 2.94Å; S246-C248 PolarHBondContact O-N 3.21Å; S246-C248 VanDerWaalsContact O-N 3.15Å
247	T	49.5	Very low	63.4	Low	89 Å²	89	99 Å²	99	55%	0.546	56%	0.559	S	S	.	*			trans	-60.5	110.5	165.5	43	0	0	0	0	108.9	N245 K249	N245-T247 VanDerWaalsContact C-N 3.28Å; N245-T247 PolarHBondContact O-N 2.89Å; T247-K249 PolarHBondContact O-N 3.27Å
248	C	49.8	Very low	65.1	Low	76 Å²	76	93.9 Å²	93.9	51%	0.514	53%	0.529	S	S	.	.			trans	-63	97.7	169.3	-175.2	0	0	0	0	108.3	S246 I250	S246-C248 PolarHBondContact O-N 3.21Å; S246-C248 VanDerWaalsContact O-N 3.15Å; C248-I250 PolarHBondContact O-N 2.92Å
249	K	70.7	Confident	67.4	Low	82 Å²	82	93.8 Å²	93.8	36%	0.357	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	113.4	-179.9	-174	-174.1	168.2	-151.4	0	107	V7 T247 E251	V7-K249 PolarHBondContact N-O 3.47Å; V7-K249 PolarHBondContact O-N 2.99Å; T247-K249 PolarHBondContact O-N 3.27Å; K249-E251 HydrophobicContact CD-CG 3.83Å; K249-E251 VanDerWaalsContact CD-OE1 3.29Å; K249-E251 WeakPolarHBondContact CD-OE1 3.38Å; K249-E251 WeakPolarHBondContact CE-OE1 3.43Å; K249-E251 HydrophobicContact CG-CG 3.94Å; K249-E251 IonicContact NZ-OE1 3.12Å; K249-E251 PolarHBondContact NZ-OE1 2.99Å; K249-E251 PolarHBondContact O-N 2.86Å
250	I	77.7	Confident	69.2	Low	109 Å²	109	88.8 Å²	88.8	56%	0.559	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.6	165.3	-58.2	177.5	0	0	0	106.2	D4 L5 C248	D4-I250 HydrophobicContact CB-CG2 3.93Å; L5-I250 WeakPolarHBondContact O-CA 3.37Å; C248-I250 PolarHBondContact O-N 2.92Å
251	E	82.5	Confident	71.2	Confident	8 Å²	8	84.2 Å²	84.2	4%	0.037	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	100.6	174.7	-65.9	-171.6	162.5	0	0	107.2	L5 V7 Q9 K249 L287	L5-E251 PolarHBondContact N-O 3.16Å; L5-E251 PolarHBondContact O-N 3.44Å; V7-E251 HydrophobicContact CB-CG 4.08Å; V7-E251 HydrophobicContact CG2-CB 3.92Å; V7-E251 HydrophobicContact CG2-CG 3.9Å; V7-E251 WeakPolarHBondContact CG2-OE2 3.29Å; Q9-E251 PolarHBondContact NE2-OE1 3.47Å; K249-E251 HydrophobicContact CD-CG 3.83Å; K249-E251 VanDerWaalsContact CD-OE1 3.29Å; K249-E251 WeakPolarHBondContact CD-OE1 3.38Å; K249-E251 WeakPolarHBondContact CE-OE1 3.43Å; K249-E251 HydrophobicContact CG-CG 3.94Å; K249-E251 IonicContact NZ-OE1 3.12Å; K249-E251 PolarHBondContact NZ-OE1 2.99Å; K249-E251 PolarHBondContact O-N 2.86Å; E251-L287 HydrophobicContact CB-CD1 4.03Å; E251-L287 HydrophobicContact CB-CD2 4.45Å; E251-L287 VanDerWaalsContact OE2-CD2 3.32Å; E251-L287 WeakPolarHBondContact OE2-CD2 3.44Å
252	T	86.3	Confident	73.4	Confident	83 Å²	83	88.2 Å²	88.2	51%	0.509	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	125.8	173.9	-59.4	0	0	0	0	109.3	T2 D4	T2-T252 HydrophobicContact CG2-CG2 3.87Å; D4-T252 WeakPolarHBondContact OD1-CA 3.43Å; D4-T252 VanDerWaalsContact OD1-CB 3.26Å; D4-T252 WeakPolarHBondContact OD1-CB 3.32Å; D4-T252 VanDerWaalsContact OD1-CG2 3.29Å; D4-T252 WeakPolarHBondContact OD1-CG2 3.48Å; D4-T252 PolarHBondContact OD1-OG1 3.15Å
253	M	91.2	Very high	75.7	Confident	1 Å²	1	84.1 Å²	84.1	1%	0.005	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.9	-178.5	-54.3	176.8	160	0	0	111.1	T2 I3 L5 I285 L287 V292 P310 F311	T2-M253 WeakPolarHBondContact CA-O 3.41Å; T2-M253 WeakPolarHBondContact CG2-O 3.29Å; I3-M253 HydrophobicContact CB-CB 4.46Å; I3-M253 PolarHBondContact N-O 3.47Å; I3-M253 PolarHBondContact O-N 3.34Å; L5-M253 HydrophobicContact CD2-CE 4.12Å; M253-I285 HydrophobicContact CB-CG2 3.51Å; M253-I285 HydrophobicContact CG-CG2 4.25Å; M253-I285 HydrophobicContact SD-CG2 3.81Å; M253-L287 HydrophobicContact CE-CB 4.17Å; M253-L287 HydrophobicContact CE-CD2 3.98Å; M253-L287 HydrophobicContact CG-CB 4.26Å; M253-L287 HydrophobicContact CG-CD1 4.37Å; M253-V292 HydrophobicContact CE-CG2 3.97Å; M253-V292 HydrophobicContact SD-CG2 4.12Å; M253-P310 HydrophobicContact CE-CG 3.21Å; M253-F311 HydrophobicContact CE-CD2 4.33Å; M253-F311 HydrophobicContact CE-CE2 3.84Å; M253-F311 HydrophobicContact CE-CZ 4.15Å; M253-F311 HydrophobicContact SD-CD2 4.44Å; M253-F311 HydrophobicContact SD-CE1 4.33Å; M253-F311 HydrophobicContact SD-CE2 3.42Å; M253-F311 WeakPolarHBondContact SD-CE2 3.43Å; M253-F311 HydrophobicContact SD-CZ 3.36Å; M253-F311 WeakPolarHBondContact SD-CZ 3.21Å
254	T	90.5	Very high	77.5	Confident	73 Å²	73	84.8 Å²	84.8	45%	0.448	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.2	-178.9	49.6	0	0	0	0	111.7	T2 I285 E286	T2-T254 HydrophobicContact CG2-CG2 4.42Å; T254-I285 WeakPolarHBondContact O-CA 3.28Å; T254-E286 PolarHBondContact N-O 2.9Å; T254-E286 PolarHBondContact O-N 3.14Å
255	N	92.5	Very high	79.8	Confident	51 Å²	51	83 Å²	83	27%	0.273	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.1	163.5	177.2	58	0	0	0	110.1	M1 F283 Q284 I285	M1-N255 HydrophobicContact CB-CB 4.35Å; M1-N255 PolarHBondContact O-N 3.39Å; N255-F283 WeakPolarHBondContact OD1-CB 3.45Å; N255-Q284 CarbonylContact C-O 3.58Å; N255-Q284 WeakPolarHBondContact CA-O 3.49Å; N255-Q284 PolarHBondContact OD1-N 3.5Å; N255-Q284 PolarHBondContact OD1-O 2.94Å; N255-I285 HydrophobicContact CB-CD1 4.39Å
256	K	92.6	Very high	82	Confident	65 Å²	65	82.4 Å²	82.4	28%	0.283	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-60.2	135.1	174.1	-167.4	170.5	-165.1	148.3	0	111	L269 Q284 E286	K256-L269 HydrophobicContact CB-CD2 3.84Å; K256-L269 HydrophobicContact CD-CD2 3.84Å; K256-L269 HydrophobicContact CG-CD2 3.73Å; K256-Q284 HydrophobicContact CB-CB 4.03Å; K256-Q284 HydrophobicContact CD-CB 4.42Å; K256-Q284 VanDerWaalsContact CD-OE1 3.25Å; K256-Q284 PolarHBondContact N-O 3.3Å; K256-E286 HydrophobicContact CB-CG 4.11Å; K256-E286 HydrophobicContact CD-CG 4.28Å; K256-E286 VanDerWaalsContact CD-OE1 3.29Å; K256-E286 WeakPolarHBondContact CD-OE1 3.31Å; K256-E286 WeakPolarHBondContact CE-OE1 3.49Å; K256-E286 HydrophobicContact CG-CG 4.32Å; K256-E286 IonicContact NZ-OE1 3.33Å; K256-E286 PolarHBondContact NZ-OE1 3.12Å
257	T	89.9	Confident	83.9	Confident	121 Å²	121	86.2 Å²	86.2	74%	0.742	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-70.7	128.3	171.1	-51.8	0	0	0	0	109.1
258	P	90.1	Very high	85.7	Confident	48 Å²	48	84.7 Å²	84.7	31%	0.312	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-64.2	143.9	173.9	28.6	-35.1	0	0	0	110.6	Y267 Q268 L269	P258-Y267 HydrophobicContact CG-CD1 4.39Å; P258-Q268 CarbonylContact C-O 3.56Å; P258-Q268 VanDerWaalsContact CA-O 3.27Å; P258-Q268 WeakPolarHBondContact CA-O 3.47Å; P258-Q268 WeakPolarHBondContact CB-O 3.38Å; P258-L269 HydrophobicContact CB-CD2 4.37Å; P258-L269 HydrophobicContact CB-CG 4.22Å
259	F	88.6	Confident	87.7	Confident	101 Å²	101	82 Å²	82	44%	0.443	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	152.9	173.5	72.1	-87.1	0	0	0	110.4	N261 Y267 Q268 D270	F259-N261 HydrophobicContact CE2-CB 4.13Å; F259-Y267 WeakPolarHBondContact O-CA 3.43Å; F259-Q268 WeakPolarHBondContact CD1-O 3.35Å; F259-Q268 HydrophobicContact CE1-CG 4.2Å; F259-Q268 HydrophobicContact CE2-CG 4.21Å; F259-Q268 HydrophobicContact CZ-CG 3.92Å; F259-Q268 PolarHBondContact N-O 3.2Å; F259-Q268 PolarHBondContact O-N 2.86Å; F259-D270 HydrophobicContact CE1-CB 4.21Å
260	W	91.8	Very high	88.6	Confident	103 Å²	103	83.2 Å²	83.2	39%	0.39	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.4	172.7	178.8	-109.2	0	0	0	110	Q265 Y267	W260-Q265 HydrophobicContact CH2-CB 4.09Å; W260-Q265 WeakPolarHBondContact CH2-O 3.35Å; W260-Q265 HydrophobicContact CZ2-CB 4.15Å; W260-Q265 VanDerWaalsContact CZ3-C 3.5Å; W260-Q265 WeakPolarHBondContact CZ3-O 3.42Å; W260-Y267 HydrophobicContact CB-CD1 4.36Å; W260-Y267 HydrophobicContact CB-CE1 4Å; W260-Y267 HydrophobicContact CE3-CD1 4.37Å; W260-Y267 AromaticContact CE3-CD2 3.65Å; W260-Y267 HydrophobicContact CE3-CD2 3.65Å; W260-Y267 HydrophobicContact CE3-CE1 4.26Å; W260-Y267 AromaticContact CE3-CE2 3.52Å; W260-Y267 HydrophobicContact CE3-CE2 3.52Å; W260-Y267 HydrophobicContact CE3-CG 4.08Å; W260-Y267 AromaticContact CE3-CZ 3.84Å; W260-Y267 AromaticContact CZ3-CD2 3.9Å; W260-Y267 HydrophobicContact CZ3-CD2 3.9Å; W260-Y267 AromaticContact CZ3-CE2 3.82Å; W260-Y267 HydrophobicContact CZ3-CE2 3.82Å
261	N	88.8	Confident	89.3	Confident	30 Å²	30	79.3 Å²	79.3	16%	0.16	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	108.2	170.1	179.8	-1.8	0	0	0	109.6	F259 Q263 N264 Q265 V266 Q268	F259-N261 HydrophobicContact CE2-CB 4.13Å; N261-Q263 VanDerWaalsContact C-N 3.31Å; N261-Q263 PolarHBondContact O-N 2.94Å; N261-Q263 WeakPolarHBondContact OD1-CB 3.24Å; N261-Q263 PolarHBondContact OD1-N 3.01Å; N261-N264 HydrophobicContact CB-CB 4.44Å; N261-N264 PolarHBondContact ND2-ND2 3.1Å; N261-N264 VanDerWaalsContact ND2-ND2 3.18Å; N261-N264 PolarHBondContact O-N 3.46Å; N261-Q265 WeakPolarHBondContact O-CA 3.21Å; N261-Q265 PolarHBondContact O-N 2.87Å; N261-V266 PolarHBondContact N-O 3.02Å; N261-V266 PolarHBondContact O-N 2.98Å; N261-Q268 HydrophobicContact CB-CG 3.82Å; N261-Q268 PolarHBondContact ND2-OE1 3.08Å
262	E	90.9	Very high	89.7	Confident	151 Å²	151	81.9 Å²	81.9	71%	0.706	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.5	179.3	-64.6	-174.8	163.6	0	0	113.4	N264 Q265	E262-N264 VanDerWaalsContact C-N 3.33Å; E262-N264 PolarHBondContact O-N 3.08Å; E262-Q265 PolarHBondContact O-NE2 3.29Å
263	Q	89.1	Confident	89.9	Confident	174 Å²	174	81 Å²	81	81%	0.813	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-36.3	180	-177.5	179.1	-11.7	0	0	112	N261	N261-Q263 VanDerWaalsContact C-N 3.31Å; N261-Q263 PolarHBondContact O-N 2.94Å; N261-Q263 WeakPolarHBondContact OD1-CB 3.24Å; N261-Q263 PolarHBondContact OD1-N 3.01Å
264	N	86.4	Confident	89.9	Confident	97 Å²	97	88.1 Å²	88.1	52%	0.519	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-5.1	-176.6	-67.6	-4.4	0	0	0	113.1	N261 E262 V266 Q268	N261-N264 HydrophobicContact CB-CB 4.44Å; N261-N264 PolarHBondContact ND2-ND2 3.1Å; N261-N264 VanDerWaalsContact ND2-ND2 3.18Å; N261-N264 PolarHBondContact O-N 3.46Å; E262-N264 VanDerWaalsContact C-N 3.33Å; E262-N264 PolarHBondContact O-N 3.08Å; N264-V266 VanDerWaalsContact C-N 3.25Å; N264-V266 HydrophobicContact CB-CG1 3.71Å; N264-V266 PolarHBondContact O-N 3.44Å; N264-Q268 PolarHBondContact ND2-OE1 3.21Å
265	Q	91.1	Very high	90	Very high	130 Å²	130	85.7 Å²	85.7	61%	0.607	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	41.6	-174.6	-61.9	-72.7	-66.7	0	0	113.2	W260 N261 E262	W260-Q265 HydrophobicContact CH2-CB 4.09Å; W260-Q265 WeakPolarHBondContact CH2-O 3.35Å; W260-Q265 HydrophobicContact CZ2-CB 4.15Å; W260-Q265 VanDerWaalsContact CZ3-C 3.5Å; W260-Q265 WeakPolarHBondContact CZ3-O 3.42Å; N261-Q265 WeakPolarHBondContact O-CA 3.21Å; N261-Q265 PolarHBondContact O-N 2.87Å; E262-Q265 PolarHBondContact O-NE2 3.29Å
266	V	85.8	Confident	89.9	Confident	62 Å²	62	87.2 Å²	87.2	38%	0.376	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148	-173.7	74.9	0	0	0	0	112.3	N261 N264 Q268	N261-V266 PolarHBondContact N-O 3.02Å; N261-V266 PolarHBondContact O-N 2.98Å; N264-V266 VanDerWaalsContact C-N 3.25Å; N264-V266 HydrophobicContact CB-CG1 3.71Å; N264-V266 PolarHBondContact O-N 3.44Å; V266-Q268 HydrophobicContact CG1-CB 4.38Å; V266-Q268 HydrophobicContact CG1-CG 4.37Å
267	Y	86.1	Confident	89.7	Confident	156 Å²	156	87 Å²	87	61%	0.612	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.8	167.1	-77.5	-80.1	0	0	0	110	P258 F259 W260	P258-Y267 HydrophobicContact CG-CD1 4.39Å; F259-Y267 WeakPolarHBondContact O-CA 3.43Å; W260-Y267 HydrophobicContact CB-CD1 4.36Å; W260-Y267 HydrophobicContact CB-CE1 4Å; W260-Y267 HydrophobicContact CE3-CD1 4.37Å; W260-Y267 AromaticContact CE3-CD2 3.65Å; W260-Y267 HydrophobicContact CE3-CD2 3.65Å; W260-Y267 HydrophobicContact CE3-CE1 4.26Å; W260-Y267 AromaticContact CE3-CE2 3.52Å; W260-Y267 HydrophobicContact CE3-CE2 3.52Å; W260-Y267 HydrophobicContact CE3-CG 4.08Å; W260-Y267 AromaticContact CE3-CZ 3.84Å; W260-Y267 AromaticContact CZ3-CD2 3.9Å; W260-Y267 HydrophobicContact CZ3-CD2 3.9Å; W260-Y267 AromaticContact CZ3-CE2 3.82Å; W260-Y267 HydrophobicContact CZ3-CE2 3.82Å
268	Q	87.3	Confident	89.5	Confident	57 Å²	57	90 Å²	90	27%	0.266	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	163.8	-177.5	55.7	172.2	88.9	0	0	112.9	P258 F259 N261 N264 V266	P258-Q268 CarbonylContact C-O 3.56Å; P258-Q268 VanDerWaalsContact CA-O 3.27Å; P258-Q268 WeakPolarHBondContact CA-O 3.47Å; P258-Q268 WeakPolarHBondContact CB-O 3.38Å; F259-Q268 WeakPolarHBondContact CD1-O 3.35Å; F259-Q268 HydrophobicContact CE1-CG 4.2Å; F259-Q268 HydrophobicContact CE2-CG 4.21Å; F259-Q268 HydrophobicContact CZ-CG 3.92Å; F259-Q268 PolarHBondContact N-O 3.2Å; F259-Q268 PolarHBondContact O-N 2.86Å; N261-Q268 HydrophobicContact CB-CG 3.82Å; N261-Q268 PolarHBondContact ND2-OE1 3.08Å; N264-Q268 PolarHBondContact ND2-OE1 3.21Å; V266-Q268 HydrophobicContact CG1-CB 4.38Å; V266-Q268 HydrophobicContact CG1-CG 4.37Å
269	L	91.1	Very high	89.3	Confident	20 Å²	20	89.9 Å²	89.9	11%	0.105	46%	0.46	C	S	.	.			trans	-111.9	142.9	167.3	-68.9	167.2	0	0	0	107.6	K256 P258 F271 Q284	K256-L269 HydrophobicContact CB-CD2 3.84Å; K256-L269 HydrophobicContact CD-CD2 3.84Å; K256-L269 HydrophobicContact CG-CD2 3.73Å; P258-L269 HydrophobicContact CB-CD2 4.37Å; P258-L269 HydrophobicContact CB-CG 4.22Å; L269-F271 HydrophobicContact CB-CD2 4.2Å; L269-F271 HydrophobicContact CB-CE2 3.58Å; L269-F271 HydrophobicContact CB-CZ 3.77Å; L269-F271 HydrophobicContact CD1-CE2 4.49Å; L269-F271 HydrophobicContact CD1-CZ 3.93Å; L269-F271 HydrophobicContact CG-CZ 4.49Å; L269-F271 VanDerWaalsContact O-CD2 3.23Å; L269-F271 WeakPolarHBondContact O-CD2 3.42Å; L269-F271 PolarHBondContact O-N 3.41Å; L269-Q284 HydrophobicContact CD1-CB 4.47Å; L269-Q284 HydrophobicContact CD1-CG 4.34Å
270	D	91.1	Very high	88.9	Confident	108 Å²	108	89.1 Å²	89.1	58%	0.578	47%	0.473	S	S	*	.			trans	-83.9	106.7	173.8	177.1	18.9	0	0	0	109.8	F259 G272 Q284	F259-D270 HydrophobicContact CE1-CB 4.21Å; D270-G272 PolarHBondContact OD1-N 3.32Å; D270-Q284 PolarHBondContact O-NE2 3.02Å
271	F	92.3	Very high	88.7	Confident	26 Å²	26	86.7 Å²	86.7	11%	0.114	47%	0.465	C	S	.	.			trans	-90.5	6.3	177.8	-65.4	-85.5	0	0	0	113.5	L269 G273 R274 V275 N282 Q284 Q294	L269-F271 HydrophobicContact CB-CD2 4.2Å; L269-F271 HydrophobicContact CB-CE2 3.58Å; L269-F271 HydrophobicContact CB-CZ 3.77Å; L269-F271 HydrophobicContact CD1-CE2 4.49Å; L269-F271 HydrophobicContact CD1-CZ 3.93Å; L269-F271 HydrophobicContact CG-CZ 4.49Å; L269-F271 VanDerWaalsContact O-CD2 3.23Å; L269-F271 WeakPolarHBondContact O-CD2 3.42Å; L269-F271 PolarHBondContact O-N 3.41Å; F271-G273 PolarHBondContact O-N 3.02Å; F271-R274 VanDerWaalsContact O-CB 3.28Å; F271-R274 WeakPolarHBondContact O-CB 3.37Å; F271-R274 PolarHBondContact O-N 2.92Å; F271-V275 HydrophobicContact CB-CB 3.67Å; F271-V275 HydrophobicContact CB-CG2 3.85Å; F271-V275 HydrophobicContact CD1-CB 3.91Å; F271-V275 HydrophobicContact CD1-CG2 3.38Å; F271-V275 HydrophobicContact CD2-CB 3.99Å; F271-V275 HydrophobicContact CD2-CG1 4.25Å; F271-V275 HydrophobicContact CD2-CG2 4.38Å; F271-V275 HydrophobicContact CE1-CG2 4Å; F271-V275 HydrophobicContact CE2-CG1 4.5Å; F271-V275 HydrophobicContact CG-CB 3.6Å; F271-V275 HydrophobicContact CG-CG1 4.29Å; F271-V275 HydrophobicContact CG-CG2 3.63Å; F271-N282 HydrophobicContact CE1-CB 4.3Å; F271-N282 HydrophobicContact CE2-CB 4.1Å; F271-N282 HydrophobicContact CZ-CB 3.61Å; F271-Q284 HydrophobicContact CD1-CG 4.24Å; F271-Q284 HydrophobicContact CE1-CG 3.82Å; F271-Q284 HydrophobicContact CZ-CG 4.47Å; F271-Q294 HydrophobicContact CD1-CG 3.71Å; F271-Q294 HydrophobicContact CE1-CG 4.17Å
272	G	90.1	Very high	88.8	Confident	62 Å²	62	86.5 Å²	86.5	64%	0.639	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	32.2	-179.5	0	0	0	0	0	113.6	D270 R274	D270-G272 PolarHBondContact OD1-N 3.32Å; G272-R274 PolarHBondContact O-N 3.22Å
273	G	91.2	Very high	88.9	Confident	65 Å²	65	79.9 Å²	79.9	67%	0.67	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	2.3	-174.5	0	0	0	0	0	115.9	F271 V275	F271-G273 PolarHBondContact O-N 3.02Å; G273-V275 VanDerWaalsContact C-N 3.34Å
274	R	91.3	Very high	89.2	Confident	151 Å²	151	71.7 Å²	71.7	57%	0.57	40%	0.395	S	S	*	.	S	Bend	trans	-71.5	-25.1	177.8	-70.4	-65.7	-162.2	-133.6	-2.4	114.2	F271 G272 I298 T304 D306	F271-R274 VanDerWaalsContact O-CB 3.28Å; F271-R274 WeakPolarHBondContact O-CB 3.37Å; F271-R274 PolarHBondContact O-N 2.92Å; G272-R274 PolarHBondContact O-N 3.22Å; R274-I298 WeakPolarHBondContact O-CG2 3.42Å; R274-T304 HydrophobicContact CB-CG2 4.17Å; R274-T304 WeakPolarHBondContact O-CG2 3.48Å; R274-D306 IonicContact NE-OD1 3.59Å; R274-D306 PolarHBondContact NE-OD1 3.36Å
275	V	92.1	Very high	89.6	Confident	21 Å²	21	67.1 Å²	67.1	13%	0.127	37%	0.37	C	S	.	.			trans	-116.5	125.6	-178.9	173.7	0	0	0	0	107.6	F271 G273 N282 R297 T304	F271-V275 HydrophobicContact CB-CB 3.67Å; F271-V275 HydrophobicContact CB-CG2 3.85Å; F271-V275 HydrophobicContact CD1-CB 3.91Å; F271-V275 HydrophobicContact CD1-CG2 3.38Å; F271-V275 HydrophobicContact CD2-CB 3.99Å; F271-V275 HydrophobicContact CD2-CG1 4.25Å; F271-V275 HydrophobicContact CD2-CG2 4.38Å; F271-V275 HydrophobicContact CE1-CG2 4Å; F271-V275 HydrophobicContact CE2-CG1 4.5Å; F271-V275 HydrophobicContact CG-CB 3.6Å; F271-V275 HydrophobicContact CG-CG1 4.29Å; F271-V275 HydrophobicContact CG-CG2 3.63Å; G273-V275 VanDerWaalsContact C-N 3.34Å; V275-N282 HydrophobicContact CG1-CB 4.38Å; V275-N282 VanDerWaalsContact CG1-ND2 3.31Å; V275-N282 WeakPolarHBondContact CG1-ND2 3.48Å; V275-R297 WeakPolarHBondContact CG1-O 3.19Å; V275-T304 HydrophobicContact CG2-CG2 3.64Å
276	T	89.9	Confident	89.8	Confident	83 Å²	83	62.5 Å²	62.5	51%	0.509	35%	0.348	S	S	.	.			trans	-119.9	-12.1	-172	66.2	0	0	0	0	114	R297 I298 E299	T276-R297 PolarHBondContact N-O 2.69Å; T276-R297 VanDerWaalsContact N-O 3.16Å; T276-I298 WeakPolarHBondContact OG1-CA 3.43Å; T276-E299 PolarHBondContact OG1-N 3.4Å
277	Q	89	Confident	90	Very high	60 Å²	60	60.5 Å²	60.5	28%	0.28	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-115.5	134.2	173.4	-76.4	-163.2	75.7	0	0	111.3	N282 R297 I298	Q277-N282 PolarHBondContact O-ND2 3.08Å; Q277-R297 HydrophobicContact CB-CB 4.04Å; Q277-R297 HydrophobicContact CB-CG 4Å; Q277-R297 PolarHBondContact N-O 3.14Å; Q277-I298 PolarHBondContact NE2-O 2.86Å
278	E	84.8	Confident	90.1	Very high	186 Å²	186	59 Å²	59	87%	0.869	34%	0.338	S	S	*	.			trans	-62.8	137.5	172.7	-65.5	179.4	-171.4	0	0	111.9
279	S	85.9	Confident	90	Very high	45 Å²	45	61.6 Å²	61.6	32%	0.315	36%	0.362	S	S	.	.			trans	-165.1	144.5	172.3	-162.2	0	0	0	0	111.5	K281 N282	S279-K281 PolarHBondContact O-N 3.39Å; S279-K281 VanDerWaalsContact O-N 3.07Å; S279-K281 PolarHBondContact OG-N 3.32Å; S279-N282 WeakPolarHBondContact CB-OD1 3.49Å; S279-N282 PolarHBondContact N-ND2 3.04Å; S279-N282 WeakPolarHBondContact O-CB 3.38Å; S279-N282 PolarHBondContact O-N 2.89Å
280	A	81.8	Confident	90	Very high	85 Å²	85	67.9 Å²	67.9	70%	0.702	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-5.5	164.7	0	0	0	0	0	113.4	L328	A280-L328 HydrophobicContact CB-CD1 3.54Å
281	K	85.8	Confident	90.1	Very high	51 Å²	51	66 Å²	66	22%	0.222	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	1.2	170.9	-64.8	-175.7	175.4	178.9	0	113.8	S279 F283 F295 S323 I324	S279-K281 PolarHBondContact O-N 3.39Å; S279-K281 VanDerWaalsContact O-N 3.07Å; S279-K281 PolarHBondContact OG-N 3.32Å; K281-F283 WeakPolarHBondContact O-CD1 3.48Å; K281-F295 VanDerWaalsContact O-CD1 3.28Å; K281-F295 WeakPolarHBondContact O-CD1 3.37Å; K281-S323 VanDerWaalsContact CE-O 3.23Å; K281-S323 WeakPolarHBondContact CE-O 3.36Å; K281-I324 PolarHBondContact NZ-O 3.01Å
282	N	91.4	Very high	90.3	Very high	26 Å²	26	65.3 Å²	65.3	14%	0.139	37%	0.374	C	S	.	.			trans	-84.9	123.1	173.5	-59.8	-12.3	0	0	0	108.8	F271 V275 Q277 S279 F295 G296 R297	F271-N282 HydrophobicContact CE1-CB 4.3Å; F271-N282 HydrophobicContact CE2-CB 4.1Å; F271-N282 HydrophobicContact CZ-CB 3.61Å; V275-N282 HydrophobicContact CG1-CB 4.38Å; V275-N282 VanDerWaalsContact CG1-ND2 3.31Å; V275-N282 WeakPolarHBondContact CG1-ND2 3.48Å; Q277-N282 PolarHBondContact O-ND2 3.08Å; S279-N282 WeakPolarHBondContact CB-OD1 3.49Å; S279-N282 PolarHBondContact N-ND2 3.04Å; S279-N282 WeakPolarHBondContact O-CB 3.38Å; S279-N282 PolarHBondContact O-N 2.89Å; N282-F295 CarbonylContact C-O 3.55Å; N282-F295 WeakPolarHBondContact CA-O 3.37Å; N282-G296 WeakPolarHBondContact OD1-CA 3.27Å; N282-R297 PolarHBondContact OD1-N 3.03Å
283	F	93.7	Very high	90.6	Very high	13 Å²	13	62.4 Å²	62.4	6%	0.057	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.9	-176.5	68.9	-90.1	0	0	0	112.9	N255 K281 I285 L293 F295 V319 S323	N255-F283 WeakPolarHBondContact OD1-CB 3.45Å; K281-F283 WeakPolarHBondContact O-CD1 3.48Å; F283-I285 HydrophobicContact CD2-CD1 3.65Å; F283-I285 HydrophobicContact CD2-CG1 3.85Å; F283-I285 HydrophobicContact CE2-CD1 3.85Å; F283-I285 HydrophobicContact CE2-CG1 3.78Å; F283-L293 HydrophobicContact CD2-CD2 4.41Å; F283-L293 HydrophobicContact CE2-CD2 3.64Å; F283-L293 HydrophobicContact CZ-CD2 4.2Å; F283-F295 HydrophobicContact CD1-CB 4.18Å; F283-F295 AromaticContact CD1-CD1 3.93Å; F283-F295 HydrophobicContact CD1-CD1 3.93Å; F283-F295 HydrophobicContact CE1-CB 3.67Å; F283-F295 AromaticContact CE1-CD1 3.39Å; F283-F295 HydrophobicContact CE1-CD1 3.39Å; F283-F295 HydrophobicContact CE1-CE1 4.36Å; F283-F295 AromaticContact CE1-CG 3.85Å; F283-F295 HydrophobicContact CE1-CG 3.85Å; F283-F295 HydrophobicContact CE2-CB 4.32Å; F283-F295 HydrophobicContact CZ-CB 3.76Å; F283-F295 HydrophobicContact CZ-CD1 4.2Å; F283-F295 HydrophobicContact CZ-CG 4.23Å; F283-F295 PolarHBondContact N-O 2.86Å; F283-F295 PolarHBondContact O-N 3.45Å; F283-F295 VanDerWaalsContact O-O 3.12Å; F283-V319 HydrophobicContact CE2-CG1 3.89Å; F283-V319 HydrophobicContact CZ-CG1 3.87Å; F283-S323 WeakPolarHBondContact CE1-OG 3.34Å
284	Q	95.6	Very high	90.8	Very high	2 Å²	2	60 Å²	60	1%	0.009	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.3	175.4	-67.7	178.8	-17.3	0	0	108.1	N255 K256 L269 D270 F271 Q291 L293 Q294	N255-Q284 CarbonylContact C-O 3.58Å; N255-Q284 WeakPolarHBondContact CA-O 3.49Å; N255-Q284 PolarHBondContact OD1-N 3.5Å; N255-Q284 PolarHBondContact OD1-O 2.94Å; K256-Q284 HydrophobicContact CB-CB 4.03Å; K256-Q284 HydrophobicContact CD-CB 4.42Å; K256-Q284 VanDerWaalsContact CD-OE1 3.25Å; K256-Q284 PolarHBondContact N-O 3.3Å; L269-Q284 HydrophobicContact CD1-CB 4.47Å; L269-Q284 HydrophobicContact CD1-CG 4.34Å; D270-Q284 PolarHBondContact O-NE2 3.02Å; F271-Q284 HydrophobicContact CD1-CG 4.24Å; F271-Q284 HydrophobicContact CE1-CG 3.82Å; F271-Q284 HydrophobicContact CZ-CG 4.47Å; Q284-Q291 HydrophobicContact CB-CG 4.4Å; Q284-Q291 VanDerWaalsContact CD-NE2 3.27Å; Q284-Q291 VanDerWaalsContact NE2-NE2 3.17Å; Q284-L293 CarbonylContact C-O 3.56Å; Q284-L293 WeakPolarHBondContact CA-O 3.17Å; Q284-Q294 HydrophobicContact CG-CG 4.32Å
285	I	95.1	Very high	91	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.7	177.2	-55.4	-60.3	0	0	0	108.9	I3 M253 T254 N255 F283 V292 L293 F311	I3-I285 HydrophobicContact CD1-CD1 3.66Å; I3-I285 HydrophobicContact CD1-CG1 3.88Å; I3-I285 HydrophobicContact CD1-CG2 4.44Å; M253-I285 HydrophobicContact CB-CG2 3.51Å; M253-I285 HydrophobicContact CG-CG2 4.25Å; M253-I285 HydrophobicContact SD-CG2 3.81Å; T254-I285 WeakPolarHBondContact O-CA 3.28Å; N255-I285 HydrophobicContact CB-CD1 4.39Å; F283-I285 HydrophobicContact CD2-CD1 3.65Å; F283-I285 HydrophobicContact CD2-CG1 3.85Å; F283-I285 HydrophobicContact CE2-CD1 3.85Å; F283-I285 HydrophobicContact CE2-CG1 3.78Å; I285-V292 HydrophobicContact CB-CG2 4.4Å; I285-V292 HydrophobicContact CG2-CG2 4.1Å; I285-V292 VanDerWaalsContact O-CG2 3.29Å; I285-V292 WeakPolarHBondContact O-CG2 3.47Å; I285-V292 PolarHBondContact O-N 2.95Å; I285-L293 HydrophobicContact CB-CB 4.15Å; I285-L293 HydrophobicContact CG1-CB 4.37Å; I285-L293 HydrophobicContact CG1-CD2 4.06Å; I285-L293 PolarHBondContact N-O 3.39Å; I285-L293 PolarHBondContact O-N 2.96Å; I285-F311 HydrophobicContact CG2-CE2 4.29Å; I285-F311 HydrophobicContact CG2-CZ 4.43Å
286	E	93.8	Very high	91.1	Very high	33 Å²	33	52.1 Å²	52.1	15%	0.154	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.5	176.6	-61.1	-166.9	136.4	0	0	112.1	T254 K256 K290	T254-E286 PolarHBondContact N-O 2.9Å; T254-E286 PolarHBondContact O-N 3.14Å; K256-E286 HydrophobicContact CB-CG 4.11Å; K256-E286 HydrophobicContact CD-CG 4.28Å; K256-E286 VanDerWaalsContact CD-OE1 3.29Å; K256-E286 WeakPolarHBondContact CD-OE1 3.31Å; K256-E286 WeakPolarHBondContact CE-OE1 3.49Å; K256-E286 HydrophobicContact CG-CG 4.32Å; K256-E286 IonicContact NZ-OE1 3.33Å; K256-E286 PolarHBondContact NZ-OE1 3.12Å; E286-K290 VanDerWaalsContact CA-O 3.28Å; E286-K290 WeakPolarHBondContact CA-O 3.42Å
287	L	90.9	Very high	91.2	Very high	20 Å²	20	52 Å²	52	11%	0.105	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128	169.5	173.1	65.7	0	0	0	106.8	E251 M253 S289 K290 V292 P310	E251-L287 HydrophobicContact CB-CD1 4.03Å; E251-L287 HydrophobicContact CB-CD2 4.45Å; E251-L287 VanDerWaalsContact OE2-CD2 3.32Å; E251-L287 WeakPolarHBondContact OE2-CD2 3.44Å; M253-L287 HydrophobicContact CE-CB 4.17Å; M253-L287 HydrophobicContact CE-CD2 3.98Å; M253-L287 HydrophobicContact CG-CB 4.26Å; M253-L287 HydrophobicContact CG-CD1 4.37Å; L287-S289 PolarHBondContact O-N 2.75Å; L287-K290 PolarHBondContact N-O 3.25Å; L287-K290 WeakPolarHBondContact O-CB 3.49Å; L287-K290 PolarHBondContact O-N 2.98Å; L287-V292 HydrophobicContact CB-CG1 4.03Å; L287-V292 HydrophobicContact CB-CG2 4.14Å; L287-P310 HydrophobicContact CD2-CG 4.05Å
288	D	87.9	Confident	91.4	Very high	125 Å²	125	51.6 Å²	51.6	67%	0.668	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	44.6	-178.9	-56.2	-26.8	0	0	0	112.9	K290	D288-K290 PolarHBondContact O-N 2.66Å
289	S	86.1	Confident	91.6	Very high	111 Å²	111	49.8 Å²	49.8	78%	0.776	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	20.1	-174.7	-55.7	0	0	0	0	115.9	L287	L287-S289 PolarHBondContact O-N 2.75Å
290	K	90.6	Very high	91.6	Very high	153 Å²	153	51.6 Å²	51.6	67%	0.665	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.9	173.6	-62.8	173.5	-171.8	172.3	0	110	E286 L287 D288 V292	E286-K290 VanDerWaalsContact CA-O 3.28Å; E286-K290 WeakPolarHBondContact CA-O 3.42Å; L287-K290 PolarHBondContact N-O 3.25Å; L287-K290 WeakPolarHBondContact O-CB 3.49Å; L287-K290 PolarHBondContact O-N 2.98Å; D288-K290 PolarHBondContact O-N 2.66Å; K290-V292 PolarHBondContact O-N 3.47Å
291	Q	93.3	Very high	91.7	Very high	67 Å²	67	49.5 Å²	49.5	31%	0.313	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	116.5	173.2	-174.3	178.7	-7.2	0	0	110.8	Q284	Q284-Q291 HydrophobicContact CB-CG 4.4Å; Q284-Q291 VanDerWaalsContact CD-NE2 3.27Å; Q284-Q291 VanDerWaalsContact NE2-NE2 3.17Å
292	V	95.1	Very high	91.8	Very high	12 Å²	12	50.1 Å²	50.1	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-21	-176.9	-72.7	0	0	0	0	113.2	M253 I285 L287 K290 F307 R308 Y309 F311	M253-V292 HydrophobicContact CE-CG2 3.97Å; M253-V292 HydrophobicContact SD-CG2 4.12Å; I285-V292 HydrophobicContact CB-CG2 4.4Å; I285-V292 HydrophobicContact CG2-CG2 4.1Å; I285-V292 VanDerWaalsContact O-CG2 3.29Å; I285-V292 WeakPolarHBondContact O-CG2 3.47Å; I285-V292 PolarHBondContact O-N 2.95Å; L287-V292 HydrophobicContact CB-CG1 4.03Å; L287-V292 HydrophobicContact CB-CG2 4.14Å; K290-V292 PolarHBondContact O-N 3.47Å; V292-F307 CarbonylContact O-C 3.55Å; V292-F307 WeakPolarHBondContact O-CA 3.24Å; V292-R308 PolarHBondContact O-N 3.3Å; V292-Y309 WeakPolarHBondContact CG1-O 3.29Å; V292-F311 HydrophobicContact CB-CD2 4.4Å; V292-F311 HydrophobicContact CB-CE2 4.49Å; V292-F311 HydrophobicContact CG2-CD2 4.32Å; V292-F311 HydrophobicContact CG2-CE2 3.92Å
293	L	96.4	Very high	91.9	Very high	2 Å²	2	53 Å²	53	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	145.7	174	-177.9	152.4	0	0	0	110.7	F283 Q284 I285 F295 L305 D306 F307 F311 A316 V319	F283-L293 HydrophobicContact CD2-CD2 4.41Å; F283-L293 HydrophobicContact CE2-CD2 3.64Å; F283-L293 HydrophobicContact CZ-CD2 4.2Å; Q284-L293 CarbonylContact C-O 3.56Å; Q284-L293 WeakPolarHBondContact CA-O 3.17Å; I285-L293 HydrophobicContact CB-CB 4.15Å; I285-L293 HydrophobicContact CG1-CB 4.37Å; I285-L293 HydrophobicContact CG1-CD2 4.06Å; I285-L293 PolarHBondContact N-O 3.39Å; I285-L293 PolarHBondContact O-N 2.96Å; L293-F295 HydrophobicContact CD2-CB 4.34Å; L293-L305 HydrophobicContact CD1-CD1 4.17Å; L293-L305 HydrophobicContact CD2-CD1 4.15Å; L293-L305 HydrophobicContact CG-CD1 4.08Å; L293-D306 CarbonylContact C-O 3.48Å; L293-D306 WeakPolarHBondContact CA-O 3.17Å; L293-F307 HydrophobicContact CB-CB 4.46Å; L293-F307 HydrophobicContact CD1-CB 4.25Å; L293-F307 HydrophobicContact CG-CB 4.28Å; L293-F311 HydrophobicContact CB-CD2 3.85Å; L293-F311 HydrophobicContact CB-CE2 3.71Å; L293-F311 HydrophobicContact CD1-CD1 4.38Å; L293-F311 HydrophobicContact CD1-CD2 3.99Å; L293-F311 HydrophobicContact CD1-CE1 4.39Å; L293-F311 HydrophobicContact CD1-CE2 3.99Å; L293-F311 HydrophobicContact CD1-CG 4.18Å; L293-F311 HydrophobicContact CD1-CZ 4.19Å; L293-A316 HydrophobicContact CD1-CB 3.56Å; L293-V319 HydrophobicContact CD1-CG1 4.4Å; L293-V319 HydrophobicContact CD2-CG1 4.44Å
294	Q	96.1	Very high	92	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.065	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	130.2	176.3	178.6	163.6	-95.1	0	0	109.2	F271 Q284 L305 D306	F271-Q294 HydrophobicContact CD1-CG 3.71Å; F271-Q294 HydrophobicContact CE1-CG 4.17Å; Q284-Q294 HydrophobicContact CG-CG 4.32Å; Q294-L305 CarbonylContact O-C 3.57Å; Q294-L305 WeakPolarHBondContact O-CA 3.46Å; Q294-D306 HydrophobicContact CB-CB 4.12Å; Q294-D306 PolarHBondContact N-O 2.6Å; Q294-D306 PolarHBondContact NE2-OD2 3.07Å; Q294-D306 PolarHBondContact O-N 2.8Å
295	F	95.9	Very high	92	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.6	173.3	177.2	-96.1	0	0	0	110	K281 N282 F283 L293 Y303 T304 L305 A320 I324	K281-F295 VanDerWaalsContact O-CD1 3.28Å; K281-F295 WeakPolarHBondContact O-CD1 3.37Å; N282-F295 CarbonylContact C-O 3.55Å; N282-F295 WeakPolarHBondContact CA-O 3.37Å; F283-F295 HydrophobicContact CD1-CB 4.18Å; F283-F295 AromaticContact CD1-CD1 3.93Å; F283-F295 HydrophobicContact CD1-CD1 3.93Å; F283-F295 HydrophobicContact CE1-CB 3.67Å; F283-F295 AromaticContact CE1-CD1 3.39Å; F283-F295 HydrophobicContact CE1-CD1 3.39Å; F283-F295 HydrophobicContact CE1-CE1 4.36Å; F283-F295 AromaticContact CE1-CG 3.85Å; F283-F295 HydrophobicContact CE1-CG 3.85Å; F283-F295 HydrophobicContact CE2-CB 4.32Å; F283-F295 HydrophobicContact CZ-CB 3.76Å; F283-F295 HydrophobicContact CZ-CD1 4.2Å; F283-F295 HydrophobicContact CZ-CG 4.23Å; F283-F295 PolarHBondContact N-O 2.86Å; F283-F295 PolarHBondContact O-N 3.45Å; F283-F295 VanDerWaalsContact O-O 3.12Å; L293-F295 HydrophobicContact CD2-CB 4.34Å; F295-Y303 AromaticContact CE1-CD1 3.77Å; F295-Y303 HydrophobicContact CE1-CD1 3.77Å; F295-Y303 HydrophobicContact CE1-CE1 4.22Å; F295-Y303 HydrophobicContact CE2-CD1 4.02Å; F295-Y303 AromaticContact CE2-CG 3.98Å; F295-Y303 HydrophobicContact CE2-CG 3.98Å; F295-Y303 AromaticContact CZ-CD1 3.27Å; F295-Y303 HydrophobicContact CZ-CD1 3.27Å; F295-Y303 HydrophobicContact CZ-CD2 4.49Å; F295-Y303 AromaticContact CZ-CE1 3.95Å; F295-Y303 HydrophobicContact CZ-CE1 3.95Å; F295-Y303 AromaticContact CZ-CG 3.6Å; F295-Y303 HydrophobicContact CZ-CG 3.6Å; F295-T304 WeakPolarHBondContact CA-O 3.42Å; F295-T304 WeakPolarHBondContact CD2-O 3.29Å; F295-L305 HydrophobicContact CB-CD1 4.16Å; F295-L305 HydrophobicContact CD2-CB 4.21Å; F295-L305 HydrophobicContact CD2-CD1 4.13Å; F295-A320 HydrophobicContact CD2-CB 3.63Å; F295-A320 HydrophobicContact CE2-CB 3.72Å; F295-A320 HydrophobicContact CG-CB 4.2Å; F295-A320 HydrophobicContact CZ-CB 4.36Å; F295-I324 HydrophobicContact CE1-CG1 4.2Å; F295-I324 HydrophobicContact CE2-CD1 4.33Å; F295-I324 HydrophobicContact CZ-CD1 3.75Å; F295-I324 HydrophobicContact CZ-CG1 3.75Å
296	G	94.1	Very high	92.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178	170.2	174.8	0	0	0	0	0	113.8	N282 Y303 T304	N282-G296 WeakPolarHBondContact OD1-CA 3.27Å; G296-Y303 CarbonylContact O-C 3.57Å; G296-Y303 VanDerWaalsContact O-CA 3.26Å; G296-Y303 WeakPolarHBondContact O-CA 3.39Å; G296-Y303 WeakPolarHBondContact O-CB 3.46Å; G296-T304 PolarHBondContact N-O 3.43Å; G296-T304 PolarHBondContact O-N 3.1Å
297	R	92.6	Very high	92.2	Very high	82 Å²	82	60.9 Å²	60.9	31%	0.309	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	139.4	-172.5	-163.4	179.2	-173.8	-163.1	0.1	112.2	V275 T276 Q277 N282 Y303	V275-R297 WeakPolarHBondContact CG1-O 3.19Å; T276-R297 PolarHBondContact N-O 2.69Å; T276-R297 VanDerWaalsContact N-O 3.16Å; Q277-R297 HydrophobicContact CB-CB 4.04Å; Q277-R297 HydrophobicContact CB-CG 4Å; Q277-R297 PolarHBondContact N-O 3.14Å; N282-R297 PolarHBondContact OD1-N 3.03Å; R297-Y303 HydrophobicContact CB-CD1 3.98Å; R297-Y303 HydrophobicContact CB-CE1 3.9Å; R297-Y303 HydrophobicContact CG-CD1 4.21Å; R297-Y303 HydrophobicContact CG-CE1 3.91Å
298	I	93.1	Very high	92.3	Very high	51 Å²	51	68.7 Å²	68.7	26%	0.262	37%	0.366	S	S	.	.			trans	-119.8	176.8	170.9	58.3	168.5	0	0	0	109.9	R274 T276 Q277 S302	R274-I298 WeakPolarHBondContact O-CG2 3.42Å; T276-I298 WeakPolarHBondContact OG1-CA 3.43Å; Q277-I298 PolarHBondContact NE2-O 2.86Å; I298-S302 VanDerWaalsContact CG1-C 3.46Å; I298-S302 WeakPolarHBondContact CG1-O 3.43Å; I298-S302 PolarHBondContact N-O 3.43Å
299	E	88.3	Confident	92.3	Very high	147 Å²	147	70 Å²	70	69%	0.687	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-61.5	170.4	177.7	-64	-167.8	169.8	0	0	113.4	T276 G301 S302	T276-E299 PolarHBondContact OG1-N 3.4Å; E299-G301 PolarHBondContact O-N 3.12Å; E299-S302 PolarHBondContact O-N 2.88Å
300	G	86.1	Confident	92.6	Very high	84 Å²	84	65.5 Å²	65.5	87%	0.866	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	66.9	5.3	-177.1	0	0	0	0	0	115.3	S302	G300-S302 VanDerWaalsContact C-N 3.33Å
301	G	83.6	Confident	92.4	Very high	40 Å²	40	58.7 Å²	58.7	41%	0.412	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	83.2	7.1	-176.5	0	0	0	0	0	114.6	E299	E299-G301 PolarHBondContact O-N 3.12Å
302	S	89.1	Confident	92.3	Very high	65 Å²	65	58.1 Å²	58.1	46%	0.455	31%	0.305	S	S	.	.			trans	-84.6	174.3	178.6	-66.9	0	0	0	0	112.6	I298 E299 G300	I298-S302 VanDerWaalsContact CG1-C 3.46Å; I298-S302 WeakPolarHBondContact CG1-O 3.43Å; I298-S302 PolarHBondContact N-O 3.43Å; E299-S302 PolarHBondContact O-N 2.88Å; G300-S302 VanDerWaalsContact C-N 3.33Å
303	Y	93.4	Very high	92	Very high	86 Å²	86	59.7 Å²	59.7	34%	0.337	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.6	177.9	-61.4	-96.6	0	0	0	110.4	F295 G296 R297	F295-Y303 AromaticContact CE1-CD1 3.77Å; F295-Y303 HydrophobicContact CE1-CD1 3.77Å; F295-Y303 HydrophobicContact CE1-CE1 4.22Å; F295-Y303 HydrophobicContact CE2-CD1 4.02Å; F295-Y303 AromaticContact CE2-CG 3.98Å; F295-Y303 HydrophobicContact CE2-CG 3.98Å; F295-Y303 AromaticContact CZ-CD1 3.27Å; F295-Y303 HydrophobicContact CZ-CD1 3.27Å; F295-Y303 HydrophobicContact CZ-CD2 4.49Å; F295-Y303 AromaticContact CZ-CE1 3.95Å; F295-Y303 HydrophobicContact CZ-CE1 3.95Å; F295-Y303 AromaticContact CZ-CG 3.6Å; F295-Y303 HydrophobicContact CZ-CG 3.6Å; G296-Y303 CarbonylContact O-C 3.57Å; G296-Y303 VanDerWaalsContact O-CA 3.26Å; G296-Y303 WeakPolarHBondContact O-CA 3.39Å; G296-Y303 WeakPolarHBondContact O-CB 3.46Å; R297-Y303 HydrophobicContact CB-CD1 3.98Å; R297-Y303 HydrophobicContact CB-CE1 3.9Å; R297-Y303 HydrophobicContact CG-CD1 4.21Å; R297-Y303 HydrophobicContact CG-CE1 3.91Å
304	T	95	Very high	91.5	Very high	24 Å²	24	63.1 Å²	63.1	15%	0.147	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	150.2	165.2	-166.4	0	0	0	0	110.3	R274 V275 F295 G296	R274-T304 HydrophobicContact CB-CG2 4.17Å; R274-T304 WeakPolarHBondContact O-CG2 3.48Å; V275-T304 HydrophobicContact CG2-CG2 3.64Å; F295-T304 WeakPolarHBondContact CA-O 3.42Å; F295-T304 WeakPolarHBondContact CD2-O 3.29Å; G296-T304 PolarHBondContact N-O 3.43Å; G296-T304 PolarHBondContact O-N 3.1Å
305	L	96.4	Very high	91.2	Very high	51 Å²	51	65.6 Å²	65.6	27%	0.267	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	91.9	172.7	178	59	0	0	0	108.9	L293 Q294 F295 A316 F317 A320	L293-L305 HydrophobicContact CD1-CD1 4.17Å; L293-L305 HydrophobicContact CD2-CD1 4.15Å; L293-L305 HydrophobicContact CG-CD1 4.08Å; Q294-L305 CarbonylContact O-C 3.57Å; Q294-L305 WeakPolarHBondContact O-CA 3.46Å; F295-L305 HydrophobicContact CB-CD1 4.16Å; F295-L305 HydrophobicContact CD2-CB 4.21Å; F295-L305 HydrophobicContact CD2-CD1 4.13Å; L305-A316 HydrophobicContact CD1-CB 4.37Å; L305-A316 HydrophobicContact CD2-CB 4.26Å; L305-F317 HydrophobicContact CD2-CB 4.42Å; L305-A320 HydrophobicContact CD1-CB 4.26Å; L305-A320 HydrophobicContact CD2-CB 4.07Å
306	D	96.3	Very high	90.9	Very high	53 Å²	53	65.3 Å²	65.3	28%	0.283	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.2	172.1	-42.1	-91.8	0	0	0	108.5	R274 L293 Q294	R274-D306 IonicContact NE-OD1 3.59Å; R274-D306 PolarHBondContact NE-OD1 3.36Å; L293-D306 CarbonylContact C-O 3.48Å; L293-D306 WeakPolarHBondContact CA-O 3.17Å; Q294-D306 HydrophobicContact CB-CB 4.12Å; Q294-D306 PolarHBondContact N-O 2.6Å; Q294-D306 PolarHBondContact NE2-OD2 3.07Å; Q294-D306 PolarHBondContact O-N 2.8Å
307	F	95.7	Very high	90.7	Very high	85 Å²	85	68.5 Å²	68.5	37%	0.373	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.7	177.4	70.7	-84.8	0	0	0	112.1	V292 L293 F311 A313 A316	V292-F307 CarbonylContact O-C 3.55Å; V292-F307 WeakPolarHBondContact O-CA 3.24Å; L293-F307 HydrophobicContact CB-CB 4.46Å; L293-F307 HydrophobicContact CD1-CB 4.25Å; L293-F307 HydrophobicContact CG-CB 4.28Å; F307-F311 HydrophobicContact CB-CB 4.39Å; F307-F311 HydrophobicContact CD2-CB 4.11Å; F307-F311 WeakPolarHBondContact CD2-O 3.26Å; F307-A313 HydrophobicContact CE1-CB 4.16Å; F307-A313 HydrophobicContact CE2-CB 4.34Å; F307-A313 VanDerWaalsContact CZ-CA 3.48Å; F307-A313 HydrophobicContact CZ-CB 3.64Å; F307-A316 HydrophobicContact CB-CB 3.73Å; F307-A316 HydrophobicContact CD1-CB 3.85Å; F307-A316 HydrophobicContact CD2-CB 4.18Å; F307-A316 HydrophobicContact CG-CB 3.63Å
308	R	92.5	Very high	90.5	Very high	184 Å²	184	67.3 Å²	67.3	69%	0.694	38%	0.38	S	S	*	.			trans	-139	170.5	-179.1	-56.4	-176.2	72.1	175.9	2.6	109.8	V292 F311	V292-R308 PolarHBondContact O-N 3.3Å; R308-F311 WeakPolarHBondContact O-CB 3.42Å; R308-F311 PolarHBondContact O-N 3.46Å
309	Y	89.6	Confident	90.3	Very high	154 Å²	154	65.8 Å²	65.8	60%	0.604	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	135.1	167.3	178.2	-83.1	0	0	0	110.5	V7 V292	V7-Y309 WeakPolarHBondContact CG1-OH 3.29Å; V292-Y309 WeakPolarHBondContact CG1-O 3.29Å
310	P	91.4	Very high	90.4	Very high	15 Å²	15	58.9 Å²	58.9	10%	0.097	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	cis	-88.7	1.5	10.6	36	-39.1	0	0	0	116.2	L5 V7 M253 L287	L5-P310 HydrophobicContact CD2-CB 4.26Å; L5-P310 HydrophobicContact CD2-CG 3.9Å; V7-P310 HydrophobicContact CB-CB 4.46Å; V7-P310 HydrophobicContact CG1-CB 3.87Å; V7-P310 HydrophobicContact CG2-CB 3.66Å; V7-P310 HydrophobicContact CG2-CG 3.92Å; M253-P310 HydrophobicContact CE-CG 3.21Å; L287-P310 HydrophobicContact CD2-CG 4.05Å
311	F	87.1	Confident	90.5	Very high	10 Å²	10	58.3 Å²	58.3	4%	0.044	32%	0.318	C	S	.	.			trans	-70.2	135.8	-178.6	-73.9	-72.2	0	0	0	113.2	L5 M253 I285 V292 L293 F307 R308 Q315 A316 V319	L5-F311 HydrophobicContact CD1-CD1 4.46Å; L5-F311 HydrophobicContact CD1-CE1 4.23Å; L5-F311 HydrophobicContact CD2-CD1 3.94Å; L5-F311 HydrophobicContact CD2-CE1 4.03Å; L5-F311 HydrophobicContact CD2-CG 4.44Å; M253-F311 HydrophobicContact CE-CD2 4.33Å; M253-F311 HydrophobicContact CE-CE2 3.84Å; M253-F311 HydrophobicContact CE-CZ 4.15Å; M253-F311 HydrophobicContact SD-CD2 4.44Å; M253-F311 HydrophobicContact SD-CE1 4.33Å; M253-F311 HydrophobicContact SD-CE2 3.42Å; M253-F311 WeakPolarHBondContact SD-CE2 3.43Å; M253-F311 HydrophobicContact SD-CZ 3.36Å; M253-F311 WeakPolarHBondContact SD-CZ 3.21Å; I285-F311 HydrophobicContact CG2-CE2 4.29Å; I285-F311 HydrophobicContact CG2-CZ 4.43Å; V292-F311 HydrophobicContact CB-CD2 4.4Å; V292-F311 HydrophobicContact CB-CE2 4.49Å; V292-F311 HydrophobicContact CG2-CD2 4.32Å; V292-F311 HydrophobicContact CG2-CE2 3.92Å; L293-F311 HydrophobicContact CB-CD2 3.85Å; L293-F311 HydrophobicContact CB-CE2 3.71Å; L293-F311 HydrophobicContact CD1-CD1 4.38Å; L293-F311 HydrophobicContact CD1-CD2 3.99Å; L293-F311 HydrophobicContact CD1-CE1 4.39Å; L293-F311 HydrophobicContact CD1-CE2 3.99Å; L293-F311 HydrophobicContact CD1-CG 4.18Å; L293-F311 HydrophobicContact CD1-CZ 4.19Å; F307-F311 HydrophobicContact CB-CB 4.39Å; F307-F311 HydrophobicContact CD2-CB 4.11Å; F307-F311 WeakPolarHBondContact CD2-O 3.26Å; R308-F311 WeakPolarHBondContact O-CB 3.42Å; R308-F311 PolarHBondContact O-N 3.46Å; F311-Q315 HydrophobicContact CD1-CB 3.88Å; F311-A316 HydrophobicContact CB-CB 4.36Å; F311-V319 HydrophobicContact CE1-CG2 4.15Å
312	S	90.1	Very high	90.6	Very high	55 Å²	55	58 Å²	58	39%	0.385	31%	0.311	S	S	.	.			trans	-84.2	161.5	157.1	78.6	0	0	0	0	111.3	A314 Q315 A316	S312-A314 VanDerWaalsContact C-N 3.27Å; S312-A314 PolarHBondContact O-N 3.43Å; S312-Q315 PolarHBondContact O-N 3.33Å; S312-Q315 VanDerWaalsContact O-N 3.11Å; S312-Q315 WeakPolarHBondContact OG-CG 3.45Å; S312-Q315 PolarHBondContact OG-N 2.82Å; S312-Q315 PolarHBondContact OG-OE1 3.43Å; S312-A316 WeakPolarHBondContact O-CB 3.48Å; S312-A316 PolarHBondContact O-N 3.12Å
313	A	88.5	Confident	90.4	Very high	46 Å²	46	55.5 Å²	55.5	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-54.4	-42.6	177.5	0	0	0	0	0	112.5	F307 A316 F317	F307-A313 HydrophobicContact CE1-CB 4.16Å; F307-A313 HydrophobicContact CE2-CB 4.34Å; F307-A313 VanDerWaalsContact CZ-CA 3.48Å; F307-A313 HydrophobicContact CZ-CB 3.64Å; A313-A316 PolarHBondContact O-N 3.45Å; A313-F317 WeakPolarHBondContact O-CB 3.37Å; A313-F317 PolarHBondContact O-N 2.95Å
314	A	87	Confident	89.8	Confident	73 Å²	73	54.2 Å²	54.2	60%	0.603	29%	0.292	S	S	*	.	H	α-helix	trans	-65.8	-38.9	178.4	0	0	0	0	0	112.8	S312 A318	S312-A314 VanDerWaalsContact C-N 3.27Å; S312-A314 PolarHBondContact O-N 3.43Å; A314-A318 WeakPolarHBondContact O-CB 3.37Å; A314-A318 PolarHBondContact O-N 3.37Å
315	Q	89.4	Confident	88.6	Confident	67 Å²	67	58.3 Å²	58.3	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-68.7	-45.8	176.3	-68.2	167.1	-29.8	0	0	111.2	L5 F311 S312 F317 A318 V319	L5-Q315 HydrophobicContact CD1-CG 4.36Å; F311-Q315 HydrophobicContact CD1-CB 3.88Å; S312-Q315 PolarHBondContact O-N 3.33Å; S312-Q315 VanDerWaalsContact O-N 3.11Å; S312-Q315 WeakPolarHBondContact OG-CG 3.45Å; S312-Q315 PolarHBondContact OG-N 2.82Å; S312-Q315 PolarHBondContact OG-OE1 3.43Å; Q315-F317 VanDerWaalsContact C-N 3.33Å; Q315-F317 PolarHBondContact O-N 2.84Å; Q315-A318 PolarHBondContact O-N 3.06Å; Q315-V319 WeakPolarHBondContact O-CG2 3.42Å; Q315-V319 PolarHBondContact O-N 3.09Å
316	A	90.2	Very high	86.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-43.1	176.2	0	0	0	0	0	111.8	L293 L305 F307 F311 S312 A313 V319 A320	L293-A316 HydrophobicContact CD1-CB 3.56Å; L305-A316 HydrophobicContact CD1-CB 4.37Å; L305-A316 HydrophobicContact CD2-CB 4.26Å; F307-A316 HydrophobicContact CB-CB 3.73Å; F307-A316 HydrophobicContact CD1-CB 3.85Å; F307-A316 HydrophobicContact CD2-CB 4.18Å; F307-A316 HydrophobicContact CG-CB 3.63Å; F311-A316 HydrophobicContact CB-CB 4.36Å; S312-A316 WeakPolarHBondContact O-CB 3.48Å; S312-A316 PolarHBondContact O-N 3.12Å; A313-A316 PolarHBondContact O-N 3.45Å; A316-V319 PolarHBondContact O-N 2.77Å; A316-A320 PolarHBondContact O-N 3.48Å
317	F	89.4	Confident	84.6	Confident	67 Å²	67	69.5 Å²	69.5	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-40.3	177.3	-174.5	-117	0	0	0	112.5	F43 L305 A313 Q315 V319 A320 L321	F43-F317 HydrophobicContact CE1-CE1 4.24Å; F43-F317 HydrophobicContact CE1-CZ 4.39Å; L305-F317 HydrophobicContact CD2-CB 4.42Å; A313-F317 WeakPolarHBondContact O-CB 3.37Å; A313-F317 PolarHBondContact O-N 2.95Å; Q315-F317 VanDerWaalsContact C-N 3.33Å; Q315-F317 PolarHBondContact O-N 2.84Å; F317-V319 VanDerWaalsContact C-N 3.35Å; F317-V319 PolarHBondContact O-N 3.01Å; F317-A320 PolarHBondContact O-N 3.44Å; F317-L321 HydrophobicContact CD1-CD1 3.95Å; F317-L321 HydrophobicContact CD1-CG 4.42Å; F317-L321 HydrophobicContact CE1-CD1 3.57Å; F317-L321 HydrophobicContact CE1-CG 4.15Å; F317-L321 HydrophobicContact CE2-CD2 4.41Å; F317-L321 HydrophobicContact CE2-CG 4.35Å; F317-L321 HydrophobicContact CZ-CD1 3.94Å; F317-L321 HydrophobicContact CZ-CD2 4.14Å; F317-L321 HydrophobicContact CZ-CG 4.11Å; F317-L321 WeakPolarHBondContact O-CG 3.44Å; F317-L321 PolarHBondContact O-N 3.33Å
318	A	88.6	Confident	82.4	Confident	57 Å²	57	71.4 Å²	71.4	47%	0.471	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-40.5	174.1	0	0	0	0	0	112.3	A314 Q315 L321 A322	A314-A318 WeakPolarHBondContact O-CB 3.37Å; A314-A318 PolarHBondContact O-N 3.37Å; Q315-A318 PolarHBondContact O-N 3.06Å; A318-L321 PolarHBondContact O-N 3.48Å; A318-A322 PolarHBondContact O-N 3.26Å
319	V	89.6	Confident	79.7	Confident	18 Å²	18	75.5 Å²	75.5	11%	0.109	39%	0.393	C	S	.	.	H	α-helix	trans	-63.3	-42.5	174.2	167.2	0	0	0	0	111.5	M1 I3 F283 L293 F311 Q315 A316 F317 A322 S323	M1-V319 HydrophobicContact CE-CG1 4.2Å; I3-V319 HydrophobicContact CD1-CB 4.46Å; I3-V319 HydrophobicContact CD1-CG1 3.6Å; I3-V319 HydrophobicContact CD1-CG2 3.94Å; I3-V319 HydrophobicContact CG2-CG2 4.43Å; F283-V319 HydrophobicContact CE2-CG1 3.89Å; F283-V319 HydrophobicContact CZ-CG1 3.87Å; L293-V319 HydrophobicContact CD1-CG1 4.4Å; L293-V319 HydrophobicContact CD2-CG1 4.44Å; F311-V319 HydrophobicContact CE1-CG2 4.15Å; Q315-V319 WeakPolarHBondContact O-CG2 3.42Å; Q315-V319 PolarHBondContact O-N 3.09Å; A316-V319 PolarHBondContact O-N 2.77Å; F317-V319 VanDerWaalsContact C-N 3.35Å; F317-V319 PolarHBondContact O-N 3.01Å; V319-A322 PolarHBondContact O-N 2.6Å; V319-S323 PolarHBondContact O-N 3.41Å
320	A	89.9	Confident	79.2	Confident	3 Å²	3	71.6 Å²	71.6	3%	0.025	38%	0.382	C	S	.	.	H	α-helix	trans	-62.8	-46.8	174.1	0	0	0	0	0	112.3	F295 L305 A316 F317 A322 S323 I324	F295-A320 HydrophobicContact CD2-CB 3.63Å; F295-A320 HydrophobicContact CE2-CB 3.72Å; F295-A320 HydrophobicContact CG-CB 4.2Å; F295-A320 HydrophobicContact CZ-CB 4.36Å; L305-A320 HydrophobicContact CD1-CB 4.26Å; L305-A320 HydrophobicContact CD2-CB 4.07Å; A316-A320 PolarHBondContact O-N 3.48Å; F317-A320 PolarHBondContact O-N 3.44Å; A320-A322 VanDerWaalsContact C-N 3.31Å; A320-A322 PolarHBondContact O-N 3.46Å; A320-S323 PolarHBondContact O-N 3.02Å; A320-S323 VanDerWaalsContact O-N 3.15Å; A320-I324 WeakPolarHBondContact O-CG1 3.45Å; A320-I324 PolarHBondContact O-N 3.07Å
321	L	88.1	Confident	78.6	Confident	72 Å²	72	74.5 Å²	74.5	38%	0.377	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-37.3	176.7	-73.1	179.6	0	0	0	112.6	F317 A318 S323 I324 T325	F317-L321 HydrophobicContact CD1-CD1 3.95Å; F317-L321 HydrophobicContact CD1-CG 4.42Å; F317-L321 HydrophobicContact CE1-CD1 3.57Å; F317-L321 HydrophobicContact CE1-CG 4.15Å; F317-L321 HydrophobicContact CE2-CD2 4.41Å; F317-L321 HydrophobicContact CE2-CG 4.35Å; F317-L321 HydrophobicContact CZ-CD1 3.94Å; F317-L321 HydrophobicContact CZ-CD2 4.14Å; F317-L321 HydrophobicContact CZ-CG 4.11Å; F317-L321 WeakPolarHBondContact O-CG 3.44Å; F317-L321 PolarHBondContact O-N 3.33Å; A318-L321 PolarHBondContact O-N 3.48Å; L321-S323 PolarHBondContact O-N 3.39Å; L321-I324 PolarHBondContact O-N 3.3Å; L321-T325 WeakPolarHBondContact O-CB 3.36Å; L321-T325 WeakPolarHBondContact O-CG2 3.28Å; L321-T325 PolarHBondContact O-N 3.39Å; L321-T325 PolarHBondContact O-OG1 3.2Å
322	A	86.3	Confident	78.1	Confident	34 Å²	34	78.1 Å²	78.1	28%	0.281	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-42.8	174.6	0	0	0	0	0	111.7	A318 V319 A320 T325 Q326	A318-A322 PolarHBondContact O-N 3.26Å; V319-A322 PolarHBondContact O-N 2.6Å; A320-A322 VanDerWaalsContact C-N 3.31Å; A320-A322 PolarHBondContact O-N 3.46Å; A322-T325 PolarHBondContact O-N 3.29Å; A322-T325 PolarHBondContact O-OG1 3.32Å; A322-Q326 WeakPolarHBondContact O-CG 3.42Å; A322-Q326 PolarHBondContact O-N 3.31Å; A322-Q326 VanDerWaalsContact O-N 3.11Å
323	S	84.3	Confident	77.4	Confident	12 Å²	12	79.5 Å²	79.5	8%	0.084	42%	0.419	C	S	.	.	H	α-helix	trans	-67.6	-37.9	174.9	-177.5	0	0	0	0	112.8	K281 F283 V319 A320 L321	K281-S323 VanDerWaalsContact CE-O 3.23Å; K281-S323 WeakPolarHBondContact CE-O 3.36Å; F283-S323 WeakPolarHBondContact CE1-OG 3.34Å; V319-S323 PolarHBondContact O-N 3.41Å; A320-S323 PolarHBondContact O-N 3.02Å; A320-S323 VanDerWaalsContact O-N 3.15Å; L321-S323 PolarHBondContact O-N 3.39Å
324	I	80.9	Confident	76.7	Confident	59 Å²	59	81.6 Å²	81.6	30%	0.303	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-38.7	176.2	-64.3	165.5	0	0	0	111.6	K281 F295 A320 L321	K281-I324 PolarHBondContact NZ-O 3.01Å; F295-I324 HydrophobicContact CE1-CG1 4.2Å; F295-I324 HydrophobicContact CE2-CD1 4.33Å; F295-I324 HydrophobicContact CZ-CD1 3.75Å; F295-I324 HydrophobicContact CZ-CG1 3.75Å; A320-I324 WeakPolarHBondContact O-CG1 3.45Å; A320-I324 PolarHBondContact O-N 3.07Å; L321-I324 PolarHBondContact O-N 3.3Å
325	T	70.4	Confident	76	Confident	110 Å²	110	82.1 Å²	82.1	68%	0.675	41%	0.409	S	S	*	.	H	α-helix	trans	-83.1	-21.2	-175.5	50.9	0	0	0	0	114.1	L321 A322 R327	L321-T325 WeakPolarHBondContact O-CB 3.36Å; L321-T325 WeakPolarHBondContact O-CG2 3.28Å; L321-T325 PolarHBondContact O-N 3.39Å; L321-T325 PolarHBondContact O-OG1 3.2Å; A322-T325 PolarHBondContact O-N 3.29Å; A322-T325 PolarHBondContact O-OG1 3.32Å; T325-R327 PolarHBondContact O-N 3.27Å
326	Q	59.6	Low	75.1	Confident	112 Å²	112	83.2 Å²	83.2	52%	0.523	42%	0.416	S	S	.	.			trans	-64.1	116.8	172.4	-78.8	176.6	14.6	0	0	111.6	A322 L328	A322-Q326 WeakPolarHBondContact O-CG 3.42Å; A322-Q326 PolarHBondContact O-N 3.31Å; A322-Q326 VanDerWaalsContact O-N 3.11Å; Q326-L328 PolarHBondContact O-N 3.46Å
327	R	47.5	Very low	73.9	Confident	226 Å²	226	89.6 Å²	89.6	85%	0.853	45%	0.448	S	S	*	.			trans	-79.7	103.9	160.4	-105.4	-179.4	164.8	159.4	-5.2	108	T325 K329	T325-R327 PolarHBondContact O-N 3.27Å; R327-K329 PolarHBondContact O-N 3.45Å
328	L	49.3	Very low	72.6	Confident	126 Å²	126	91.5 Å²	91.5	66%	0.66	46%	0.461	S	S	*	.			trans	-57.7	133.3	154.8	-63.1	169.6	0	0	0	107.6	A280 Q326	A280-L328 HydrophobicContact CB-CD1 3.54Å; Q326-L328 PolarHBondContact O-N 3.46Å
329	K	37.3	Very low	71.2	Confident	269 Å²	269	94.6 Å²	94.6	100%	1.17	46%	0.46	S	S	*	.			trans	-128.1	0	178.3	-83.1	-173.6	172.6	-176.2	0	108.1	R327	R327-K329 PolarHBondContact O-N 3.45Å

Retrieved 329 of 329 residues in 90.5 ms (Link to these results)

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