A0A077Z1L3_TRITR Loading...

poly(A)-specific ribonuclease

AlphaFold DB , UniProt , Accession A0A077Z1L3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 404 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.7	Very low	39	Very low	235 Å²	235	129.3 Å²	129.3	100%	1.158	86%	0.858	S	S	*	*				0	142.7	0	-73.9	178.4	163.2	0	0	107.8
2	S	44	Very low	38.6	Very low	123 Å²	123	134.2 Å²	134.2	86%	0.86	86%	0.86	S	S	*	*			trans	47.8	117.2	173.8	48.9	0	0	0	0	117
3	G	37.8	Very low	38.3	Very low	71 Å²	71	132 Å²	132	73%	0.732	85%	0.851	S	S	*	*			cis	84.4	130.8	36.5	0	0	0	0	0	109.2
4	V	49.1	Very low	38.1	Very low	142 Å²	142	134.6 Å²	134.6	86%	0.861	85%	0.846	S	S	*	*			cis	-153.5	149.9	26.9	168.1	0	0	0	0	110.4
5	P	42.6	Very low	37.9	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	85%	0.85	S	S	*	*			trans	-103.6	164.6	169.1	39	-32.5	0	0	0	113.6
6	G	35.6	Very low	37.8	Very low	88 Å²	88	144.5 Å²	144.5	91%	0.907	86%	0.857	S	S	*	*			trans	115.6	118.8	154	0	0	0	0	0	116.7
7	G	39.1	Very low	37.5	Very low	82 Å²	82	147.5 Å²	147.5	85%	0.845	86%	0.86	S	S	*	*			trans	-148.5	106.6	165.4	0	0	0	0	0	109.6
8	Q	34.5	Very low	37.2	Very low	192 Å²	192	144.7 Å²	144.7	90%	0.897	86%	0.857	S	S	*	*			trans	-88.4	120.7	175.1	-74.2	179	-23.6	0	0	109.7
9	G	38.2	Very low	37.4	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	86%	0.858	S	S	*	*			trans	-91.6	102.6	171.2	0	0	0	0	0	111.2
10	Q	31	Very low	37.2	Very low	190 Å²	190	144.9 Å²	144.9	89%	0.888	86%	0.86	S	S	*	*			trans	-80.4	130	161.9	-69	179.8	-13.4	0	0	108.8
11	S	36.6	Very low	36.9	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	86%	0.859	S	S	*	*			trans	-149.7	122.3	172.8	-166.7	0	0	0	0	112.9
12	Q	33.8	Very low	36.9	Very low	188 Å²	188	134.9 Å²	134.9	88%	0.879	84%	0.839	S	S	*	*			trans	63.9	83.9	153.6	-64	179.5	40.3	0	0	119.4
13	S	34.4	Very low	36.3	Very low	106 Å²	106	136.3 Å²	136.3	74%	0.741	84%	0.843	S	S	*	*			trans	-118.6	38	162.1	65.1	0	0	0	0	113.1
14	H	35.7	Very low	36.3	Very low	168 Å²	168	138 Å²	138	78%	0.778	84%	0.843	S	S	*	*			trans	-144.6	74.1	-173	-74.2	-90.1	0	0	0	113.6
15	L	35.8	Very low	36.1	Very low	173 Å²	173	136.7 Å²	136.7	91%	0.906	84%	0.835	S	S	*	*			trans	-158.9	43.7	164.7	-142	84.5	0	0	0	116.1
16	R	36.4	Very low	36.1	Very low	255 Å²	255	134.3 Å²	134.3	96%	0.962	82%	0.82	S	S	*	*			trans	-141	63.6	169.7	-80.2	-162.8	173.4	-170	-0.5	113.8
17	Q	32.6	Very low	36.7	Very low	196 Å²	196	132.4 Å²	132.4	92%	0.916	79%	0.79	S	S	*	*			trans	-143.5	103	161.9	-82.5	-174.4	-17.4	0	0	109
18	A	32.5	Very low	37	Very low	97 Å²	97	136 Å²	136	80%	0.802	79%	0.785	S	S	*	*			trans	156.7	64	153.2	0	0	0	0	0	113.6
19	V	40	Very low	37.4	Very low	144 Å²	144	135.9 Å²	135.9	87%	0.873	78%	0.776	S	S	*	*			trans	-146.2	89.3	148.9	-172.4	0	0	0	0	108.6
20	T	34	Very low	38.1	Very low	148 Å²	148	139.9 Å²	139.9	91%	0.908	77%	0.766	S	S	*	*			trans	-121.8	102.1	171	50.4	0	0	0	0	108
21	G	30	Very low	39	Very low	80 Å²	80	132 Å²	132	83%	0.825	73%	0.732	S	S	*	*			trans	-174	25.5	-167.9	0	0	0	0	0	117.3
22	A	40.2	Very low	39.6	Very low	91 Å²	91	134 Å²	134	75%	0.752	73%	0.731	S	S	*	*			trans	-149	133.5	167	0	0	0	0	0	109.6	S24	A22-S24 PolarHBondContact O-N 2.9Å; A22-S24 VanDerWaalsContact O-N 3.1Å
23	V	32.5	Very low	40.4	Very low	153 Å²	153	127 Å²	127	93%	0.927	71%	0.706	S	S	*	*			trans	-78.8	93.7	-179.9	179.4	0	0	0	0	108.8
24	S	37.8	Very low	40.7	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-79.8	123	173.9	46.2	0	0	0	0	111	A22	A22-S24 PolarHBondContact O-N 2.9Å; A22-S24 VanDerWaalsContact O-N 3.1Å
25	V	44.9	Very low	40.9	Very low	116 Å²	116	124.9 Å²	124.9	70%	0.703	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-66.1	131.8	163.5	179.4	0	0	0	0	107.3	V27	V25-V27 PolarHBondContact O-N 3.01Å; V25-V27 VanDerWaalsContact O-N 3.14Å
26	P	41.9	Very low	41.1	Very low	73 Å²	73	121.4 Å²	121.4	47%	0.474	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-63.8	118.4	-175.6	23.6	-33.4	0	0	0	111.1	Q28 R29	P26-Q28 PolarHBondContact O-N 3.24Å; P26-R29 PolarHBondContact O-N 2.85Å
27	V	49.2	Very low	41.1	Very low	47 Å²	47	114.8 Å²	114.8	29%	0.285	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-54.4	-30.7	-175.3	179.4	0	0	0	0	112.4	V25 R29 R30 Y64	V25-V27 PolarHBondContact O-N 3.01Å; V25-V27 VanDerWaalsContact O-N 3.14Å; V27-R29 PolarHBondContact O-N 3.31Å; V27-R30 WeakPolarHBondContact O-CB 3.48Å; V27-R30 PolarHBondContact O-N 2.92Å; V27-Y64 HydrophobicContact CB-CD2 4.11Å; V27-Y64 HydrophobicContact CB-CE2 3.92Å; V27-Y64 HydrophobicContact CG1-CD2 3.76Å; V27-Y64 HydrophobicContact CG1-CE2 3.86Å; V27-Y64 HydrophobicContact CG2-CE2 3.84Å
28	Q	44.5	Very low	41.3	Very low	159 Å²	159	112.2 Å²	112.2	74%	0.743	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-52.5	-24.4	173.2	-74.8	175.5	-31.7	0	0	115.2	P26	P26-Q28 PolarHBondContact O-N 3.24Å
29	R	43.5	Very low	41.7	Very low	189 Å²	189	110.6 Å²	110.6	71%	0.713	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-79.1	-18.3	173.7	-74.7	-169.3	179.7	-173	1	113.8	P26 V27	P26-R29 PolarHBondContact O-N 2.85Å; V27-R29 PolarHBondContact O-N 3.31Å
30	R	52.7	Low	42.3	Very low	163 Å²	163	114.2 Å²	114.2	62%	0.615	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-24.8	-173.8	-137.3	174.7	-178.8	-155.1	-10.6	113	V27 Q32 D57	V27-R30 WeakPolarHBondContact O-CB 3.48Å; V27-R30 PolarHBondContact O-N 2.92Å; R30-Q32 PolarHBondContact O-N 3.42Å; R30-D57 IonicContact CZ-OD2 3.22Å; R30-D57 IonicContact NH1-OD2 2.66Å; R30-D57 PolarHBondContact NH1-OD2 2.87Å; R30-D57 IonicContact NH2-OD2 3.32Å; R30-D57 PolarHBondContact NH2-OD2 3.19Å
31	C	49.6	Very low	44.3	Very low	25 Å²	25	109.5 Å²	109.5	17%	0.169	65%	0.651	C	S	.	*	S	Bend	trans	-76.7	-5	173.2	-49.3	0	0	0	0	113.7
32	Q	49.5	Very low	46.5	Very low	137 Å²	137	109.5 Å²	109.5	64%	0.64	63%	0.627	S	S	*	*	S	Bend	trans	-89.2	117.2	177.2	-62.6	-177.7	4	0	0	109.1	R30	R30-Q32 PolarHBondContact O-N 3.42Å
33	A	49.7	Very low	48.3	Very low	43 Å²	43	108.2 Å²	108.2	36%	0.355	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-62.1	136	178.8	0	0	0	0	0	111.1	S35	A33-S35 PolarHBondContact O-N 3.28Å
34	P	42.7	Very low	50.7	Low	100 Å²	100	105.7 Å²	105.7	65%	0.649	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-71	123.9	175.1	29.1	-32.9	0	0	0	110.3	S36	P34-S36 PolarHBondContact O-N 3.05Å
35	S	38.6	Very low	53.1	Low	129 Å²	129	103.3 Å²	103.3	90%	0.902	57%	0.565	S	S	*	*			trans	-75	91.6	179.4	61	0	0	0	0	111.8	A33	A33-S35 PolarHBondContact O-N 3.28Å
36	S	40.7	Very low	55.5	Low	100 Å²	100	98 Å²	98	70%	0.699	53%	0.534	S	S	*	.			trans	-145.4	121.6	169.3	56.3	0	0	0	0	112	P34	P34-S36 PolarHBondContact O-N 3.05Å
37	S	35.1	Very low	58.1	Low	115 Å²	115	94.7 Å²	94.7	80%	0.804	51%	0.512	S	S	*	.			trans	-72.2	131.9	-176.4	52.7	0	0	0	0	114.1
38	V	37.3	Very low	60.4	Low	143 Å²	143	93.9 Å²	93.9	87%	0.867	50%	0.503	S	S	*	.	S	Bend		173.7	119.7	112.8	155.6	0	0	0	0	108.1
39	G	40.9	Very low	63	Low	62 Å²	62	87.9 Å²	87.9	64%	0.639	48%	0.477	S	S	*	.	S	Bend	trans	90.2	127.9	-166.8	0	0	0	0	0	111.2	S41	G39-S41 PolarHBondContact O-N 2.99Å; G39-S41 VanDerWaalsContact O-N 3.13Å
40	R	52.4	Low	65.6	Low	220 Å²	220	78.9 Å²	78.9	83%	0.83	44%	0.443	S	S	*	.			trans	-73.5	102.4	172.2	-78.7	-174.5	179.1	177.8	-1	108	M45	R40-M45 HydrophobicContact CB-CE 4.06Å
41	S	76.4	Confident	67.8	Low	50 Å²	50	71.8 Å²	71.8	35%	0.35	42%	0.416	S	S	.	.			trans	-67	163	166	67.3	0	0	0	0	110.2	G39 E43 D44	G39-S41 PolarHBondContact O-N 2.99Å; G39-S41 VanDerWaalsContact O-N 3.13Å; S41-E43 PolarHBondContact O-N 3.17Å; S41-E43 PolarHBondContact OG-N 2.95Å; S41-D44 WeakPolarHBondContact CB-OD2 3.37Å; S41-D44 PolarHBondContact N-OD2 3.2Å; S41-D44 WeakPolarHBondContact O-CB 3.15Å; S41-D44 PolarHBondContact O-N 2.78Å; S41-D44 VanDerWaalsContact OG-CG 3.3Å; S41-D44 PolarHBondContact OG-N 3.1Å; S41-D44 VanDerWaalsContact OG-N 3.15Å; S41-D44 PolarHBondContact OG-OD2 2.9Å
42	Y	76.7	Confident	70.1	Confident	80 Å²	80	78 Å²	78	31%	0.314	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.2	168.1	-64.1	-41.3	0	0	0	111.8	D44 M45 G46 I47 P258	Y42-D44 VanDerWaalsContact C-N 3.35Å; Y42-D44 PolarHBondContact O-N 2.92Å; Y42-M45 CarbonylContact O-C 3.55Å; Y42-M45 WeakPolarHBondContact O-CA 3.47Å; Y42-M45 VanDerWaalsContact O-CB 3.32Å; Y42-M45 WeakPolarHBondContact O-CB 3.29Å; Y42-M45 PolarHBondContact O-N 3.22Å; Y42-G46 PolarHBondContact O-N 2.99Å; Y42-I47 CarbonylContact C-O 3.59Å; Y42-I47 VanDerWaalsContact CB-O 3.3Å; Y42-I47 WeakPolarHBondContact CB-O 3.17Å; Y42-I47 PolarHBondContact O-N 2.81Å; Y42-P258 HydrophobicContact CE1-CG 3.96Å
43	E	78.1	Confident	72.5	Confident	63 Å²	63	76.8 Å²	76.8	29%	0.294	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-66.6	-35.4	177.3	-50.2	-162	173.8	0	0	112.4	S41 M45 G46 I47 R48 I127	S41-E43 PolarHBondContact O-N 3.17Å; S41-E43 PolarHBondContact OG-N 2.95Å; E43-M45 PolarHBondContact O-N 2.95Å; E43-G46 PolarHBondContact O-N 3.26Å; E43-I47 PolarHBondContact N-O 3.37Å; E43-R48 VanDerWaalsContact CD-NE 3.31Å; E43-R48 IonicContact OE1-CZ 2.84Å; E43-R48 VanDerWaalsContact OE1-CZ 3.32Å; E43-R48 IonicContact OE1-NE 3.57Å; E43-R48 PolarHBondContact OE1-NE 3.5Å; E43-R48 IonicContact OE1-NH2 3.82Å; E43-R48 PolarHBondContact OE1-NH2 3.24Å; E43-R48 VanDerWaalsContact OE1-NH2 3.15Å; E43-R48 IonicContact OE2-CZ 3.17Å; E43-R48 IonicContact OE2-NE 2.7Å; E43-R48 IonicContact OE2-NH2 3.76Å; E43-R48 PolarHBondContact OE2-NH2 2.93Å; E43-I127 HydrophobicContact CB-CD1 4.07Å; E43-I127 HydrophobicContact CG-CD1 4.48Å
44	D	82.5	Confident	74.8	Confident	100 Å²	100	76.3 Å²	76.3	54%	0.535	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-64.2	-19.8	171.7	-61	-65.4	0	0	0	112.4	S41 Y42	S41-D44 WeakPolarHBondContact CB-OD2 3.37Å; S41-D44 PolarHBondContact N-OD2 3.2Å; S41-D44 WeakPolarHBondContact O-CB 3.15Å; S41-D44 PolarHBondContact O-N 2.78Å; S41-D44 VanDerWaalsContact OG-CG 3.3Å; S41-D44 PolarHBondContact OG-N 3.1Å; S41-D44 VanDerWaalsContact OG-N 3.15Å; S41-D44 PolarHBondContact OG-OD2 2.9Å; Y42-D44 VanDerWaalsContact C-N 3.35Å; Y42-D44 PolarHBondContact O-N 2.92Å
45	M	88	Confident	77.5	Confident	56 Å²	56	71.9 Å²	71.9	28%	0.276	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-94.1	-3	174	-52.3	-168.9	-163.4	0	0	112.9	R40 Y42 E43 I256	R40-M45 HydrophobicContact CB-CE 4.06Å; Y42-M45 CarbonylContact O-C 3.55Å; Y42-M45 WeakPolarHBondContact O-CA 3.47Å; Y42-M45 VanDerWaalsContact O-CB 3.32Å; Y42-M45 WeakPolarHBondContact O-CB 3.29Å; Y42-M45 PolarHBondContact O-N 3.22Å; E43-M45 PolarHBondContact O-N 2.95Å; M45-I256 HydrophobicContact CB-CG2 3.72Å; M45-I256 HydrophobicContact CG-CG2 4.5Å
46	G	95	Very high	80.3	Confident	5 Å²	5	71.4 Å²	71.4	5%	0.052	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	16.6	-175.9	0	0	0	0	0	114.8	Y42 E43 G126 S128 T129	Y42-G46 PolarHBondContact O-N 2.99Å; E43-G46 PolarHBondContact O-N 3.26Å; G46-G126 VanDerWaalsContact CA-O 3.31Å; G46-G126 WeakPolarHBondContact CA-O 3.37Å; G46-S128 PolarHBondContact O-N 3.35Å; G46-S128 PolarHBondContact O-OG 3.27Å; G46-T129 PolarHBondContact O-N 2.9Å
47	I	97.7	Very high	83	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.8	178	-61.1	167.3	0	0	0	109	Y42 E43 T129 Q131 I256 L267	Y42-I47 CarbonylContact C-O 3.59Å; Y42-I47 VanDerWaalsContact CB-O 3.3Å; Y42-I47 WeakPolarHBondContact CB-O 3.17Å; Y42-I47 PolarHBondContact O-N 2.81Å; E43-I47 PolarHBondContact N-O 3.37Å; I47-T129 CarbonylContact C-O 2.97Å; I47-T129 WeakPolarHBondContact CA-O 3.41Å; I47-T129 HydrophobicContact CB-CG2 4.49Å; I47-T129 HydrophobicContact CG1-CG2 4.01Å; I47-T129 HydrophobicContact CG2-CG2 4.24Å; I47-Q131 HydrophobicContact CG2-CB 4.25Å; I47-I256 HydrophobicContact CD1-CG2 4.49Å; I47-L267 HydrophobicContact CD1-CD2 4.25Å; I47-L267 HydrophobicContact CG1-CD2 4.27Å
48	R	98	Very high	86.1	Confident	30 Å²	30	65 Å²	65	11%	0.113	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.2	177.6	170.5	55.6	61.6	69.5	-1.1	110	E43 E58 I127 T129 W130 Q131	E43-R48 VanDerWaalsContact CD-NE 3.31Å; E43-R48 IonicContact OE1-CZ 2.84Å; E43-R48 VanDerWaalsContact OE1-CZ 3.32Å; E43-R48 IonicContact OE1-NE 3.57Å; E43-R48 PolarHBondContact OE1-NE 3.5Å; E43-R48 IonicContact OE1-NH2 3.82Å; E43-R48 PolarHBondContact OE1-NH2 3.24Å; E43-R48 VanDerWaalsContact OE1-NH2 3.15Å; E43-R48 IonicContact OE2-CZ 3.17Å; E43-R48 IonicContact OE2-NE 2.7Å; E43-R48 IonicContact OE2-NH2 3.76Å; E43-R48 PolarHBondContact OE2-NH2 2.93Å; R48-E58 WeakPolarHBondContact CD-OE1 3.42Å; R48-E58 HydrophobicContact CG-CG 4.28Å; R48-E58 IonicContact CZ-OE1 3.5Å; R48-E58 IonicContact NE-OE1 2.7Å; R48-E58 IonicContact NH1-OE1 2.79Å; R48-E58 PolarHBondContact NH1-OE1 3.02Å; R48-E58 IonicContact NH1-OE2 2.63Å; R48-E58 PolarHBondContact NH1-OE2 3.01Å; R48-I127 HydrophobicContact CB-CD1 4.11Å; R48-I127 HydrophobicContact CB-CG1 4.23Å; R48-I127 HydrophobicContact CB-CG2 3.51Å; R48-T129 PolarHBondContact N-O 3.39Å; R48-W130 WeakPolarHBondContact O-CA 3.4Å; R48-Q131 PolarHBondContact O-N 3.46Å
49	D	98	Very high	89	Confident	34 Å²	34	58.3 Å²	58.3	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	129.6	168.7	-99.1	-35.3	0	0	0	110.7	N54 Q131 N133	D49-N54 PolarHBondContact O-ND2 3.34Å; D49-Q131 PolarHBondContact OD1-NE2 3.22Å; D49-N133 PolarHBondContact OD1-ND2 3Å
50	V	98.6	Very high	91.7	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.1	176.9	-161.6	0	0	0	0	109.2	L55 E58 W130 Q131 F132 N133 I166	V50-L55 HydrophobicContact CG1-CB 4.37Å; V50-L55 HydrophobicContact CG1-CD1 4.14Å; V50-E58 HydrophobicContact CG1-CB 4.06Å; V50-E58 HydrophobicContact CG1-CG 4.06Å; V50-E58 HydrophobicContact CG2-CB 4.15Å; V50-E58 HydrophobicContact CG2-CG 4.12Å; V50-W130 HydrophobicContact CG2-CB 4.04Å; V50-W130 HydrophobicContact CG2-CG 4.3Å; V50-Q131 PolarHBondContact N-O 3.21Å; V50-F132 HydrophobicContact CB-CD1 3.71Å; V50-F132 HydrophobicContact CB-CE1 4.05Å; V50-F132 HydrophobicContact CB-CG 4.18Å; V50-F132 HydrophobicContact CG1-CD1 3.77Å; V50-F132 HydrophobicContact CG1-CE1 3.83Å; V50-F132 HydrophobicContact CG2-CD1 4.05Å; V50-F132 HydrophobicContact CG2-CE1 4.03Å; V50-F132 HydrophobicContact CG2-CG 4.35Å; V50-F132 HydrophobicContact CG2-CZ 4.29Å; V50-N133 PolarHBondContact O-N 3.49Å; V50-N133 PolarHBondContact O-ND2 3.4Å; V50-I166 HydrophobicContact CB-CD1 4.27Å; V50-I166 HydrophobicContact CG1-CD1 4.13Å; V50-I166 WeakPolarHBondContact O-CD1 3.35Å
51	W	98.7	Very high	93.9	Very high	14 Å²	14	47.7 Å²	47.7	5%	0.053	24%	0.241	C	C	.	.			trans	-128.9	175.4	-179.5	-62.5	88.8	0	0	0	109	S53 N54 L55 N133 R160 L161 D164	W51-S53 PolarHBondContact O-N 3.16Å; W51-N54 PolarHBondContact N-OD1 3.42Å; W51-N54 PolarHBondContact O-N 3.32Å; W51-N54 PolarHBondContact O-OD1 3.29Å; W51-L55 WeakPolarHBondContact O-CB 3.42Å; W51-L55 PolarHBondContact O-N 3.47Å; W51-N133 HydrophobicContact CD2-CB 3.92Å; W51-N133 HydrophobicContact CE3-CB 3.68Å; W51-N133 HydrophobicContact CH2-CB 3.51Å; W51-N133 HydrophobicContact CZ2-CB 3.75Å; W51-N133 VanDerWaalsContact CZ2-CG 3.41Å; W51-N133 WeakPolarHBondContact CZ2-ND2 3.31Å; W51-N133 HydrophobicContact CZ3-CB 3.47Å; W51-N133 VanDerWaalsContact CZ3-CB 3.47Å; W51-R160 VanDerWaalsContact CE2-CZ 3.41Å; W51-R160 HydrophobicContact CE3-CG 4.15Å; W51-R160 HydrophobicContact CH2-CB 4.16Å; W51-R160 HydrophobicContact CH2-CG 3.64Å; W51-R160 HydrophobicContact CZ2-CG 4.22Å; W51-R160 HydrophobicContact CZ3-CB 4.24Å; W51-R160 HydrophobicContact CZ3-CG 3.6Å; W51-R160 VanDerWaalsContact NE1-NH2 3.14Å; W51-L161 HydrophobicContact CH2-CD2 4.05Å; W51-L161 HydrophobicContact CZ3-CD2 3.98Å; W51-D164 HydrophobicContact CE3-CB 3.89Å; W51-D164 HydrophobicContact CZ3-CB 4.5Å
52	K	98.5	Very high	94.9	Very high	154 Å²	154	45.3 Å²	45.3	67%	0.67	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-30.1	177.6	-178.7	179.3	175	-177.1	0	113.6	D164	K52-D164 VanDerWaalsContact CB-O 3.23Å; K52-D164 WeakPolarHBondContact CB-O 3.22Å; K52-D164 PolarHBondContact N-O 3.27Å
53	S	98.4	Very high	95.9	Very high	113 Å²	113	42.9 Å²	42.9	79%	0.79	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-31.4	-175.6	51.7	0	0	0	0	115.2	W51	W51-S53 PolarHBondContact O-N 3.16Å
54	N	98.5	Very high	96.8	Very high	32 Å²	32	45.7 Å²	45.7	17%	0.171	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-3.4	179.9	65.1	-29.4	0	0	0	114.3	D49 W51 R56 D57 E58	D49-N54 PolarHBondContact O-ND2 3.34Å; W51-N54 PolarHBondContact N-OD1 3.42Å; W51-N54 PolarHBondContact O-N 3.32Å; W51-N54 PolarHBondContact O-OD1 3.29Å; N54-R56 VanDerWaalsContact C-N 3.31Å; N54-R56 PolarHBondContact O-N 3.35Å; N54-R56 VanDerWaalsContact O-N 3.09Å; N54-D57 PolarHBondContact O-N 3.44Å; N54-D57 VanDerWaalsContact O-N 3.08Å; N54-E58 HydrophobicContact CB-CG 4.11Å; N54-E58 WeakPolarHBondContact ND2-CG 3.13Å; N54-E58 PolarHBondContact ND2-OE1 2.61Å; N54-E58 WeakPolarHBondContact O-CG 3.21Å; N54-E58 PolarHBondContact O-N 2.85Å
55	L	98.7	Very high	97.6	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-42.6	-47.6	-176.7	179.4	65.3	0	0	0	115.6	V50 W51 I59 F132 I166 K170 F171 L174	V50-L55 HydrophobicContact CG1-CB 4.37Å; V50-L55 HydrophobicContact CG1-CD1 4.14Å; W51-L55 WeakPolarHBondContact O-CB 3.42Å; W51-L55 PolarHBondContact O-N 3.47Å; L55-I59 HydrophobicContact CD1-CD1 3.63Å; L55-I59 HydrophobicContact CD1-CG1 4.35Å; L55-I59 HydrophobicContact CG-CD1 4.21Å; L55-I59 WeakPolarHBondContact O-CG1 3.31Å; L55-I59 PolarHBondContact O-N 3.42Å; L55-I59 VanDerWaalsContact O-N 3.16Å; L55-F132 HydrophobicContact CD1-CD1 3.94Å; L55-F132 HydrophobicContact CD1-CE1 3.9Å; L55-I166 HydrophobicContact CD1-CD1 3.93Å; L55-I166 HydrophobicContact CD1-CG1 4.24Å; L55-I166 HydrophobicContact CD1-CG2 4.11Å; L55-I166 HydrophobicContact CD2-CG1 4.44Å; L55-I166 HydrophobicContact CD2-CG2 3.73Å; L55-K170 HydrophobicContact CD2-CB 4.26Å; L55-K170 HydrophobicContact CD2-CG 3.9Å; L55-F171 HydrophobicContact CD1-CD2 4.25Å; L55-L174 HydrophobicContact CD2-CD1 3.87Å; L55-L174 HydrophobicContact CG-CD1 3.75Å
56	R	98.5	Very high	98.1	Very high	119 Å²	119	39.4 Å²	39.4	45%	0.449	20%	0.196	S	C	.	.	H	α-helix	trans	-68.1	-51.2	-179.2	179.4	66.3	-160.2	-164	13.7	111.3	N54 E58 I59 D60 L174	N54-R56 VanDerWaalsContact C-N 3.31Å; N54-R56 PolarHBondContact O-N 3.35Å; N54-R56 VanDerWaalsContact O-N 3.09Å; R56-E58 VanDerWaalsContact C-N 3.26Å; R56-E58 PolarHBondContact O-N 3.05Å; R56-I59 PolarHBondContact O-N 2.86Å; R56-D60 IonicContact CZ-OD1 3.75Å; R56-D60 VanDerWaalsContact CZ-OD1 3.22Å; R56-D60 IonicContact CZ-OD2 3.55Å; R56-D60 VanDerWaalsContact NE-CG 3.3Å; R56-D60 IonicContact NE-OD1 3.59Å; R56-D60 PolarHBondContact NE-OD1 3.34Å; R56-D60 IonicContact NE-OD2 3.21Å; R56-D60 PolarHBondContact NE-OD2 2.94Å; R56-D60 IonicContact NH2-OD1 2.69Å; R56-D60 PolarHBondContact NH2-OD1 3.47Å; R56-D60 IonicContact NH2-OD2 3.02Å; R56-D60 PolarHBondContact NH2-OD2 3.3Å; R56-D60 WeakPolarHBondContact O-CB 3.27Å; R56-D60 PolarHBondContact O-N 2.98Å; R56-L174 HydrophobicContact CB-CD1 4.46Å; R56-L174 VanDerWaalsContact CD-CD2 3.43Å
57	D	98.3	Very high	98.2	Very high	64 Å²	64	46 Å²	46	34%	0.342	23%	0.225	S	C	.	.	H	α-helix	trans	-57.1	-40.3	-178.7	-74.5	20.1	0	0	0	111.4	R30 N54 C61	R30-D57 IonicContact CZ-OD2 3.22Å; R30-D57 IonicContact NH1-OD2 2.66Å; R30-D57 PolarHBondContact NH1-OD2 2.87Å; R30-D57 IonicContact NH2-OD2 3.32Å; R30-D57 PolarHBondContact NH2-OD2 3.19Å; N54-D57 PolarHBondContact O-N 3.44Å; N54-D57 VanDerWaalsContact O-N 3.08Å; D57-C61 PolarHBondContact O-N 2.97Å; D57-C61 PolarHBondContact O-SG 2.92Å
58	E	98.5	Very high	98.2	Very high	15 Å²	15	50.9 Å²	50.9	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-73.6	-42.5	179.6	-60.8	-58.4	164.5	0	0	113	R48 V50 N54 R56 D60 C61 M62 W130	R48-E58 WeakPolarHBondContact CD-OE1 3.42Å; R48-E58 HydrophobicContact CG-CG 4.28Å; R48-E58 IonicContact CZ-OE1 3.5Å; R48-E58 IonicContact NE-OE1 2.7Å; R48-E58 IonicContact NH1-OE1 2.79Å; R48-E58 PolarHBondContact NH1-OE1 3.02Å; R48-E58 IonicContact NH1-OE2 2.63Å; R48-E58 PolarHBondContact NH1-OE2 3.01Å; V50-E58 HydrophobicContact CG1-CB 4.06Å; V50-E58 HydrophobicContact CG1-CG 4.06Å; V50-E58 HydrophobicContact CG2-CB 4.15Å; V50-E58 HydrophobicContact CG2-CG 4.12Å; N54-E58 HydrophobicContact CB-CG 4.11Å; N54-E58 WeakPolarHBondContact ND2-CG 3.13Å; N54-E58 PolarHBondContact ND2-OE1 2.61Å; N54-E58 WeakPolarHBondContact O-CG 3.21Å; N54-E58 PolarHBondContact O-N 2.85Å; R56-E58 VanDerWaalsContact C-N 3.26Å; R56-E58 PolarHBondContact O-N 3.05Å; E58-D60 VanDerWaalsContact C-N 3.31Å; E58-D60 PolarHBondContact O-N 2.85Å; E58-C61 WeakPolarHBondContact O-CB 3.37Å; E58-C61 PolarHBondContact O-N 3.33Å; E58-C61 VanDerWaalsContact O-N 3.12Å; E58-M62 VanDerWaalsContact O-CG 3.28Å; E58-M62 WeakPolarHBondContact O-CG 3.44Å; E58-M62 PolarHBondContact O-N 2.81Å; E58-W130 PolarHBondContact OE2-NE1 3.05Å
59	I	98.6	Very high	98.2	Very high	3 Å²	3	52 Å²	52	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-37.4	175.1	-69	174.8	0	0	0	110.8	L55 R56 C61 M62 S63 F132 F171 L174	L55-I59 HydrophobicContact CD1-CD1 3.63Å; L55-I59 HydrophobicContact CD1-CG1 4.35Å; L55-I59 HydrophobicContact CG-CD1 4.21Å; L55-I59 WeakPolarHBondContact O-CG1 3.31Å; L55-I59 PolarHBondContact O-N 3.42Å; L55-I59 VanDerWaalsContact O-N 3.16Å; R56-I59 PolarHBondContact O-N 2.86Å; I59-C61 VanDerWaalsContact C-N 3.34Å; I59-C61 PolarHBondContact O-N 3.06Å; I59-M62 PolarHBondContact O-N 3.47Å; I59-S63 PolarHBondContact O-N 3Å; I59-S63 PolarHBondContact O-OG 2.81Å; I59-F132 HydrophobicContact CD1-CE1 4.13Å; I59-F132 HydrophobicContact CG1-CE1 3.93Å; I59-F132 HydrophobicContact CG1-CZ 4.17Å; I59-F171 HydrophobicContact CD1-CD2 4.37Å; I59-L174 HydrophobicContact CD1-CB 3.56Å; I59-L174 HydrophobicContact CD1-CD1 4.12Å; I59-L174 HydrophobicContact CG2-CB 4.14Å
60	D	98.1	Very high	98.2	Very high	52 Å²	52	51.1 Å²	51.1	28%	0.278	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-41.9	171.3	-76.9	-30.2	0	0	0	111.3	R56 E58 S63 Y64	R56-D60 IonicContact CZ-OD1 3.75Å; R56-D60 VanDerWaalsContact CZ-OD1 3.22Å; R56-D60 IonicContact CZ-OD2 3.55Å; R56-D60 VanDerWaalsContact NE-CG 3.3Å; R56-D60 IonicContact NE-OD1 3.59Å; R56-D60 PolarHBondContact NE-OD1 3.34Å; R56-D60 IonicContact NE-OD2 3.21Å; R56-D60 PolarHBondContact NE-OD2 2.94Å; R56-D60 IonicContact NH2-OD1 2.69Å; R56-D60 PolarHBondContact NH2-OD1 3.47Å; R56-D60 IonicContact NH2-OD2 3.02Å; R56-D60 PolarHBondContact NH2-OD2 3.3Å; R56-D60 WeakPolarHBondContact O-CB 3.27Å; R56-D60 PolarHBondContact O-N 2.98Å; E58-D60 VanDerWaalsContact C-N 3.31Å; E58-D60 PolarHBondContact O-N 2.85Å; D60-S63 WeakPolarHBondContact O-CB 3.33Å; D60-S63 PolarHBondContact O-N 3.32Å; D60-Y64 WeakPolarHBondContact O-CD2 3.4Å; D60-Y64 WeakPolarHBondContact O-CE2 3.47Å
61	C	97.8	Very high	98.2	Very high	7 Å²	7	51.1 Å²	51.1	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-45.7	174	-69.9	0	0	0	0	112.3	D57 E58 I59 S63 Y64 V65	D57-C61 PolarHBondContact O-N 2.97Å; D57-C61 PolarHBondContact O-SG 2.92Å; E58-C61 WeakPolarHBondContact O-CB 3.37Å; E58-C61 PolarHBondContact O-N 3.33Å; E58-C61 VanDerWaalsContact O-N 3.12Å; I59-C61 VanDerWaalsContact C-N 3.34Å; I59-C61 PolarHBondContact O-N 3.06Å; C61-S63 VanDerWaalsContact C-N 3.27Å; C61-S63 PolarHBondContact O-N 3.37Å; C61-Y64 PolarHBondContact O-N 3.3Å; C61-Y64 VanDerWaalsContact O-N 3.11Å; C61-V65 WeakPolarHBondContact O-CG2 3.39Å; C61-V65 PolarHBondContact O-N 3.4Å
62	M	98.4	Very high	98.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-63.9	-32.8	179.6	-67.6	157.6	70.8	0	0	112.8	E58 I59 Y64 V65 V66 F114 F116 W130 F132 L180	E58-M62 VanDerWaalsContact O-CG 3.28Å; E58-M62 WeakPolarHBondContact O-CG 3.44Å; E58-M62 PolarHBondContact O-N 2.81Å; I59-M62 PolarHBondContact O-N 3.47Å; M62-Y64 PolarHBondContact O-N 3.23Å; M62-V65 PolarHBondContact O-N 2.97Å; M62-V66 PolarHBondContact O-N 3.49Å; M62-F114 HydrophobicContact CE-CB 4.22Å; M62-F114 HydrophobicContact CE-CD2 3.64Å; M62-F114 HydrophobicContact CE-CG 4.44Å; M62-F116 HydrophobicContact CB-CZ 4.27Å; M62-F116 HydrophobicContact CE-CE2 3.77Å; M62-F116 HydrophobicContact CE-CZ 3.76Å; M62-F116 HydrophobicContact CG-CE2 4.28Å; M62-F116 HydrophobicContact CG-CZ 4.35Å; M62-W130 HydrophobicContact CE-CB 4.21Å; M62-W130 HydrophobicContact CE-CD2 4.48Å; M62-W130 HydrophobicContact CE-CG 4.31Å; M62-W130 HydrophobicContact CG-CD2 3.5Å; M62-W130 VanDerWaalsContact CG-CD2 3.5Å; M62-W130 HydrophobicContact CG-CE3 3.81Å; M62-W130 HydrophobicContact CG-CG 3.95Å; M62-W130 HydrophobicContact CG-CH2 4.27Å; M62-W130 HydrophobicContact CG-CZ2 3.95Å; M62-W130 HydrophobicContact CG-CZ3 4.19Å; M62-W130 HydrophobicContact SD-CB 3.91Å; M62-W130 HydrophobicContact SD-CD2 3.75Å; M62-W130 HydrophobicContact SD-CE3 4.36Å; M62-W130 HydrophobicContact SD-CG 3.51Å; M62-W130 VanDerWaalsContact SD-CG 3.51Å; M62-F132 HydrophobicContact CE-CE2 3.79Å; M62-F132 HydrophobicContact CE-CZ 3.64Å; M62-F132 HydrophobicContact SD-CE2 4.16Å; M62-F132 HydrophobicContact SD-CZ 3.57Å; M62-F132 VanDerWaalsContact SD-CZ 3.57Å; M62-L180 HydrophobicContact CB-CD2 4.35Å; M62-L180 HydrophobicContact CE-CD2 3.72Å
63	S	97.9	Very high	98.3	Very high	28 Å²	28	43.1 Å²	43.1	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-29.1	174.8	-53.2	0	0	0	0	112.4	I59 D60 C61 S178	I59-S63 PolarHBondContact O-N 3Å; I59-S63 PolarHBondContact O-OG 2.81Å; D60-S63 WeakPolarHBondContact O-CB 3.33Å; D60-S63 PolarHBondContact O-N 3.32Å; C61-S63 VanDerWaalsContact C-N 3.27Å; C61-S63 PolarHBondContact O-N 3.37Å; S63-S178 WeakPolarHBondContact CB-O 3.49Å; S63-S178 WeakPolarHBondContact OG-CA 3.17Å; S63-S178 WeakPolarHBondContact OG-CB 3.45Å; S63-S178 PolarHBondContact OG-O 3.28Å
64	Y	97	Very high	98.3	Very high	123 Å²	123	37.8 Å²	37.8	48%	0.482	18%	0.18	S	C	.	.	H	α-helix	trans	-85.6	-27.7	171.2	-62.2	-70.4	0	0	0	113.5	V27 D60 C61 M62	V27-Y64 HydrophobicContact CB-CD2 4.11Å; V27-Y64 HydrophobicContact CB-CE2 3.92Å; V27-Y64 HydrophobicContact CG1-CD2 3.76Å; V27-Y64 HydrophobicContact CG1-CE2 3.86Å; V27-Y64 HydrophobicContact CG2-CE2 3.84Å; D60-Y64 WeakPolarHBondContact O-CD2 3.4Å; D60-Y64 WeakPolarHBondContact O-CE2 3.47Å; C61-Y64 PolarHBondContact O-N 3.3Å; C61-Y64 VanDerWaalsContact O-N 3.11Å; M62-Y64 PolarHBondContact O-N 3.23Å
65	V	98.2	Very high	98.3	Very high	16 Å²	16	37.1 Å²	37.1	10%	0.097	18%	0.177	C	C	.	.	H	α-helix	trans	-72	-43.2	-180	172	0	0	0	0	110.6	C61 M62 E67 N68 Y69 F116 P124 W130	C61-V65 WeakPolarHBondContact O-CG2 3.39Å; C61-V65 PolarHBondContact O-N 3.4Å; M62-V65 PolarHBondContact O-N 2.97Å; V65-E67 PolarHBondContact O-N 2.99Å; V65-E67 VanDerWaalsContact O-N 3.16Å; V65-N68 PolarHBondContact O-N 3.17Å; V65-Y69 HydrophobicContact CG1-CD2 4Å; V65-Y69 HydrophobicContact CG1-CG 4.37Å; V65-Y69 WeakPolarHBondContact O-CD2 3.35Å; V65-Y69 PolarHBondContact O-N 3.2Å; V65-F116 HydrophobicContact CG1-CB 3.86Å; V65-F116 HydrophobicContact CG1-CD1 3.84Å; V65-F116 HydrophobicContact CG1-CG 3.81Å; V65-P124 HydrophobicContact CG1-CB 4.43Å; V65-P124 HydrophobicContact CG1-CG 3.64Å; V65-W130 HydrophobicContact CG1-CH2 4.45Å; V65-W130 HydrophobicContact CG2-CH2 3.98Å
66	V	98.1	Very high	98.3	Very high	8 Å²	8	37 Å²	37	5%	0.048	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.7	-177.7	75.2	0	0	0	0	113.2	M62 N68 Y69 P70 I72 F116 L180 V186	M62-V66 PolarHBondContact O-N 3.49Å; V66-N68 PolarHBondContact O-N 2.9Å; V66-Y69 CarbonylContact O-C 3.58Å; V66-P70 WeakPolarHBondContact O-CA 3.44Å; V66-I72 HydrophobicContact CG2-CD1 4.16Å; V66-F116 HydrophobicContact CB-CE1 4.11Å; V66-F116 HydrophobicContact CG2-CE1 4.32Å; V66-L180 HydrophobicContact CB-CD1 3.94Å; V66-L180 HydrophobicContact CB-CG 4.38Å; V66-L180 HydrophobicContact CG1-CD1 3.79Å; V66-L180 HydrophobicContact CG2-CD1 4.37Å; V66-L180 HydrophobicContact CG2-CG 4.35Å; V66-V186 HydrophobicContact CG2-CG1 4.4Å; V66-V186 HydrophobicContact CG2-CG2 3.83Å
67	E	97.1	Very high	98.3	Very high	142 Å²	142	32.4 Å²	32.4	66%	0.664	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-31.4	175.8	-63.9	-173.4	162.1	0	0	113.1	V65	V65-E67 PolarHBondContact O-N 2.99Å; V65-E67 VanDerWaalsContact O-N 3.16Å
68	N	97.9	Very high	98.3	Very high	106 Å²	106	31.3 Å²	31.3	57%	0.567	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-19.8	-176	-65.1	-89.6	0	0	0	112.9	V65 V66 P70	V65-N68 PolarHBondContact O-N 3.17Å; V66-N68 PolarHBondContact O-N 2.9Å; N68-P70 VanDerWaalsContact C-CD 3.46Å
69	Y	98.6	Very high	98.3	Very high	53 Å²	53	30.6 Å²	30.6	21%	0.208	15%	0.149	C	C	.	.			trans	-128.2	67.5	-178.8	-57.8	-92.5	0	0	0	109.5	V65 V66 V71 F117 T118 R123 P124 P125	V65-Y69 HydrophobicContact CG1-CD2 4Å; V65-Y69 HydrophobicContact CG1-CG 4.37Å; V65-Y69 WeakPolarHBondContact O-CD2 3.35Å; V65-Y69 PolarHBondContact O-N 3.2Å; V66-Y69 CarbonylContact O-C 3.58Å; Y69-V71 PolarHBondContact O-N 3.32Å; Y69-V71 VanDerWaalsContact O-N 3.16Å; Y69-F117 CarbonylContact C-O 3.53Å; Y69-F117 WeakPolarHBondContact CA-O 3.34Å; Y69-T118 HydrophobicContact CD1-CG2 3.52Å; Y69-T118 HydrophobicContact CE1-CG2 3.66Å; Y69-T118 HydrophobicContact CG-CG2 4.41Å; Y69-R123 VanDerWaalsContact CE1-C 3.48Å; Y69-P124 HydrophobicContact CD1-CG 3.8Å; Y69-P124 HydrophobicContact CD2-CB 4.31Å; Y69-P124 HydrophobicContact CD2-CG 3.79Å; Y69-P124 HydrophobicContact CE1-CB 4.36Å; Y69-P124 HydrophobicContact CE1-CG 4.1Å; Y69-P124 HydrophobicContact CE2-CB 4.13Å; Y69-P124 HydrophobicContact CE2-CG 4.1Å; Y69-P124 HydrophobicContact CG-CG 3.66Å; Y69-P125 WeakPolarHBondContact OH-CD 3.48Å
70	P	98.5	Very high	98.1	Very high	16 Å²	16	31 Å²	31	10%	0.104	15%	0.154	C	C	.	.			trans	-79.7	9.7	-169.3	35.1	-40	0	0	0	114.3	V66 N68 H119 V186 L187	V66-P70 WeakPolarHBondContact O-CA 3.44Å; N68-P70 VanDerWaalsContact C-CD 3.46Å; P70-H119 WeakPolarHBondContact CG-NE2 3.5Å; P70-V186 WeakPolarHBondContact O-CA 3.29Å; P70-L187 PolarHBondContact O-N 3.43Å
71	V	98.8	Very high	98	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.7	174.6	-174.3	0	0	0	0	108.8	Y69 F116 F117 H119 L187 L189 F274	Y69-V71 PolarHBondContact O-N 3.32Å; Y69-V71 VanDerWaalsContact O-N 3.16Å; V71-F116 CarbonylContact O-C 3.57Å; V71-F117 HydrophobicContact CB-CB 4.15Å; V71-F117 WeakPolarHBondContact CB-O 3.24Å; V71-F117 PolarHBondContact N-O 2.95Å; V71-F117 PolarHBondContact O-N 2.89Å; V71-H119 WeakPolarHBondContact CG2-ND1 3.43Å; V71-L187 CarbonylContact C-O 3.53Å; V71-L187 WeakPolarHBondContact CA-O 3.49Å; V71-L187 HydrophobicContact CG1-CB 4.39Å; V71-L187 HydrophobicContact CG1-CD2 4.01Å; V71-L187 HydrophobicContact CG1-CG 4.12Å; V71-L187 HydrophobicContact CG2-CB 4.25Å; V71-L187 HydrophobicContact CG2-CD2 4.16Å; V71-L189 HydrophobicContact CG1-CD1 3.43Å; V71-L189 VanDerWaalsContact CG1-CD1 3.43Å; V71-L189 HydrophobicContact CG1-CD2 4.18Å; V71-L189 HydrophobicContact CG1-CG 3.63Å; V71-F274 HydrophobicContact CB-CZ 4.39Å; V71-F274 HydrophobicContact CG1-CE2 4.3Å; V71-F274 HydrophobicContact CG1-CZ 3.97Å; V71-F274 HydrophobicContact CG2-CZ 4.49Å
72	I	98.9	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	112.1	-175.9	-51.5	-179.1	0	0	0	108.7	V66 F114 S115 F116 L180 V186 L187 W188 L189	V66-I72 HydrophobicContact CG2-CD1 4.16Å; I72-F114 HydrophobicContact CG2-CB 3.96Å; I72-F114 HydrophobicContact CG2-CD1 4.3Å; I72-F114 HydrophobicContact CG2-CG 4.3Å; I72-S115 CarbonylContact C-O 3.58Å; I72-S115 WeakPolarHBondContact CA-O 3.4Å; I72-F116 HydrophobicContact CD1-CD1 4.42Å; I72-F116 HydrophobicContact CD1-CE1 3.61Å; I72-F116 HydrophobicContact CD1-CZ 3.99Å; I72-F116 HydrophobicContact CG1-CD1 4Å; I72-F116 HydrophobicContact CG1-CE1 3.67Å; I72-F116 HydrophobicContact CG1-CZ 4.21Å; I72-F116 HydrophobicContact CG2-CZ 4.38Å; I72-L180 HydrophobicContact CD1-CB 4.07Å; I72-L180 HydrophobicContact CD1-CD2 4.21Å; I72-L180 HydrophobicContact CD1-CG 3.81Å; I72-V186 HydrophobicContact CD1-CG1 3.58Å; I72-V186 HydrophobicContact CG1-CG1 3.87Å; I72-L187 PolarHBondContact N-O 2.99Å; I72-W188 HydrophobicContact CB-CD2 4.28Å; I72-W188 HydrophobicContact CB-CE3 4.19Å; I72-W188 HydrophobicContact CB-CZ3 4.3Å; I72-W188 HydrophobicContact CD1-CH2 4.16Å; I72-W188 HydrophobicContact CD1-CZ2 3.81Å; I72-W188 HydrophobicContact CG2-CE3 4.06Å; I72-W188 HydrophobicContact CG2-CH2 4.03Å; I72-W188 HydrophobicContact CG2-CZ3 3.75Å; I72-W188 CarbonylContact O-C 3.04Å; I72-W188 WeakPolarHBondContact O-CA 3.24Å; I72-L189 PolarHBondContact O-N 3.25Å
73	A	98.9	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	140	166.3	0	0	0	0	0	110.4	F114 S115 F117 L189 S266 T269 G270	A73-F114 WeakPolarHBondContact O-CA 3.29Å; A73-S115 PolarHBondContact N-O 2.96Å; A73-S115 PolarHBondContact O-N 3.33Å; A73-F117 HydrophobicContact CB-CD2 4.46Å; A73-F117 HydrophobicContact CB-CE2 3.85Å; A73-L189 CarbonylContact C-O 3.53Å; A73-L189 WeakPolarHBondContact CA-O 3.13Å; A73-L189 HydrophobicContact CB-CB 4Å; A73-L189 HydrophobicContact CB-CD1 4.43Å; A73-S266 WeakPolarHBondContact CB-O 3.43Å; A73-T269 HydrophobicContact CB-CG2 4.47Å; A73-G270 VanDerWaalsContact CB-CA 3.47Å
74	M	98.9	Very high	97.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.6	-169.1	-171.9	-86.3	-68.5	0	0	111.4	T76 V112 G113 F114 W188 L189 D196 F197 M200	M74-T76 HydrophobicContact SD-CG2 3.99Å; M74-V112 HydrophobicContact CG-CG2 4.06Å; M74-V112 HydrophobicContact SD-CG2 4.21Å; M74-G113 WeakPolarHBondContact CA-O 3.45Å; M74-F114 HydrophobicContact CB-CD1 4.16Å; M74-F114 HydrophobicContact CB-CE1 4.42Å; M74-F114 HydrophobicContact CG-CD1 3.64Å; M74-F114 HydrophobicContact CG-CE1 3.49Å; M74-F114 VanDerWaalsContact CG-CE1 3.49Å; M74-W188 HydrophobicContact CB-CE3 3.9Å; M74-W188 HydrophobicContact CB-CZ3 3.92Å; M74-W188 HydrophobicContact CG-CE3 4.28Å; M74-W188 HydrophobicContact CG-CZ3 3.93Å; M74-L189 PolarHBondContact N-O 3.49Å; M74-D196 HydrophobicContact CE-CB 3.65Å; M74-D196 HydrophobicContact SD-CB 3.7Å; M74-F197 HydrophobicContact CE-CD1 3.81Å; M74-F197 HydrophobicContact CE-CD2 4.19Å; M74-F197 HydrophobicContact CE-CE1 3.58Å; M74-F197 HydrophobicContact CE-CE2 3.99Å; M74-F197 HydrophobicContact CE-CG 4.1Å; M74-F197 HydrophobicContact CE-CZ 3.68Å; M74-M200 HydrophobicContact CE-CG 4.4Å
75	D	98.9	Very high	97	Very high	19 Å²	19	30.4 Å²	30.4	10%	0.102	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	156	177	-175.6	81	0	0	0	109	V112 G113 D265	D75-V112 WeakPolarHBondContact O-CG2 3.38Å; D75-G113 PolarHBondContact N-O 2.98Å; D75-G113 PolarHBondContact O-N 3.36Å; D75-D265 HydrophobicContact CB-CB 4.21Å; D75-D265 VanDerWaalsContact OD2-CB 3.31Å; D75-D265 WeakPolarHBondContact OD2-CB 3.37Å
76	T	98.8	Very high	96.4	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.4	178	70.9	0	0	0	0	114.2	M74 L109 Q111 V112 D196	M74-T76 HydrophobicContact SD-CG2 3.99Å; T76-L109 HydrophobicContact CG2-CD1 4Å; T76-Q111 WeakPolarHBondContact CA-O 3.35Å; T76-Q111 WeakPolarHBondContact CB-O 3.25Å; T76-V112 HydrophobicContact CG2-CB 4.12Å; T76-V112 HydrophobicContact CG2-CG2 3.84Å; T76-D196 WeakPolarHBondContact CB-OD1 3.28Å; T76-D196 HydrophobicContact CG2-CB 3.9Å; T76-D196 PolarHBondContact N-OD1 2.93Å; T76-D196 PolarHBondContact OG1-OD1 3.21Å
77	E	98.7	Very high	95.8	Very high	23 Å²	23	34.6 Å²	34.6	11%	0.107	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.4	167.1	-61	-65.4	179.6	0	0	110	I110 Q111 L151 H260 Q261 A262	E77-I110 WeakPolarHBondContact O-CA 3.28Å; E77-I110 WeakPolarHBondContact O-CB 3.34Å; E77-I110 PolarHBondContact O-N 3.5Å; E77-Q111 HydrophobicContact CB-CB 4.08Å; E77-Q111 HydrophobicContact CG-CB 4.38Å; E77-Q111 PolarHBondContact N-O 3.49Å; E77-Q111 PolarHBondContact O-N 3.26Å; E77-L151 HydrophobicContact CB-CD2 3.88Å; E77-L151 HydrophobicContact CG-CD2 3.94Å; E77-L151 WeakPolarHBondContact OE2-CD2 3.38Å; E77-H260 WeakPolarHBondContact OE1-CA 3.09Å; E77-Q261 PolarHBondContact OE1-N 2.84Å; E77-A262 HydrophobicContact CG-CB 4.14Å
78	F	98.3	Very high	95.3	Very high	41 Å²	41	36 Å²	36	18%	0.18	19%	0.191	C	C	.	.			trans	-150.6	161.2	-176.8	64.4	-92.9	0	0	0	110.8	G80 L109 Y195 Y199	F78-G80 WeakPolarHBondContact CE2-O 3.46Å; F78-G80 PolarHBondContact O-N 2.81Å; F78-L109 HydrophobicContact CB-CD1 4.39Å; F78-Y195 HydrophobicContact CE1-CG 4.37Å; F78-Y195 AromaticContact CE2-CD1 3.74Å; F78-Y195 HydrophobicContact CE2-CD1 3.74Å; F78-Y195 HydrophobicContact CE2-CE1 4.29Å; F78-Y195 HydrophobicContact CE2-CG 4.27Å; F78-Y195 AromaticContact CZ-CD1 3.66Å; F78-Y195 HydrophobicContact CZ-CD1 3.66Å; F78-Y195 HydrophobicContact CZ-CE1 4.49Å; F78-Y195 AromaticContact CZ-CG 3.71Å; F78-Y195 HydrophobicContact CZ-CG 3.71Å; F78-Y199 HydrophobicContact CB-CD2 4.31Å; F78-Y199 HydrophobicContact CB-CE2 3.52Å; F78-Y199 HydrophobicContact CD1-CD2 4.17Å; F78-Y199 AromaticContact CD1-CE2 3.65Å; F78-Y199 HydrophobicContact CD1-CE2 3.65Å; F78-Y199 AromaticContact CD2-CE2 3.66Å; F78-Y199 HydrophobicContact CD2-CE2 3.66Å; F78-Y199 AromaticContact CD2-CZ 3.97Å; F78-Y199 WeakPolarHBondContact CD2-OH 3.24Å; F78-Y199 HydrophobicContact CE1-CE2 4.22Å; F78-Y199 HydrophobicContact CE2-CE2 4.22Å; F78-Y199 HydrophobicContact CG-CD2 4.23Å; F78-Y199 AromaticContact CG-CE2 3.33Å; F78-Y199 HydrophobicContact CG-CE2 3.33Å; F78-Y199 AromaticContact CG-CZ 3.85Å; F78-Y199 HydrophobicContact CZ-CE2 4.48Å
79	P	97.4	Very high	94.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.			trans	-79.8	37.1	-168.2	34.4	-39.6	0	0	0	114.4	L107 K108 I110 F136 Y143 A144 I148	P79-L107 HydrophobicContact CG-CB 3.98Å; P79-L107 HydrophobicContact CG-CD1 4.24Å; P79-L107 HydrophobicContact CG-CD2 4.03Å; P79-L107 HydrophobicContact CG-CG 4.3Å; P79-K108 WeakPolarHBondContact CD-O 3.25Å; P79-I110 HydrophobicContact CB-CD1 4.04Å; P79-I110 HydrophobicContact CG-CD1 4.42Å; P79-F136 HydrophobicContact CB-CE2 4.33Å; P79-F136 HydrophobicContact CB-CZ 3.99Å; P79-F136 HydrophobicContact CG-CE2 3.87Å; P79-F136 HydrophobicContact CG-CZ 3.96Å; P79-Y143 VanDerWaalsContact CB-CB 3.49Å; P79-A144 WeakPolarHBondContact O-CB 3.43Å; P79-A144 PolarHBondContact O-N 2.9Å; P79-I148 HydrophobicContact CB-CD1 4.05Å
80	G	95.2	Very high	94.2	Very high	11 Å²	11	41.7 Å²	41.7	11%	0.113	21%	0.205	C	C	.	.			trans	76.4	-141.7	172.8	0	0	0	0	0	115.4	F78 L107 S147	F78-G80 WeakPolarHBondContact CE2-O 3.46Å; F78-G80 PolarHBondContact O-N 2.81Å; G80-L107 WeakPolarHBondContact O-CD1 3.44Å; G80-S147 WeakPolarHBondContact CA-OG 3.43Å
81	I	94.9	Very high	93.6	Very high	58 Å²	58	43.5 Å²	43.5	30%	0.297	22%	0.218	S	C	.	.			trans	-129.1	123.7	-176.4	-66.1	175.3	0	0	0	107.6	L99 N103 Y195	I81-L99 HydrophobicContact CG2-CD1 4.41Å; I81-N103 WeakPolarHBondContact CA-OD1 3.36Å; I81-Y195 WeakPolarHBondContact CD1-OH 2.94Å; I81-Y195 HydrophobicContact CG1-CE1 4.25Å
82	V	93.6	Very high	93	Very high	22 Å²	22	48.7 Å²	48.7	13%	0.133	25%	0.25	C	S	.	.			trans	-117.5	-15.7	-177.2	-58.6	0	0	0	0	113.5	N103 L106 L107 Y143 A144 V340 V341	V82-N103 PolarHBondContact N-OD1 3.39Å; V82-L106 HydrophobicContact CG2-CD1 4.23Å; V82-L107 HydrophobicContact CG1-CD1 4.41Å; V82-L107 HydrophobicContact CG1-CD2 3.95Å; V82-L107 HydrophobicContact CG2-CD1 4.27Å; V82-L107 HydrophobicContact CG2-CD2 3.77Å; V82-L107 HydrophobicContact CG2-CG 4.19Å; V82-Y143 VanDerWaalsContact CG1-C 3.4Å; V82-A144 HydrophobicContact CG1-CB 4.32Å; V82-V340 CarbonylContact O-C 3.57Å; V82-V340 VanDerWaalsContact O-CA 3.29Å; V82-V340 WeakPolarHBondContact O-CA 3.45Å; V82-V341 PolarHBondContact O-N 3.1Å
83	A	92.7	Very high	92.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156.6	-176.4	0	0	0	0	0	112.5	L99 N103 L106 V341 L343	A83-L99 WeakPolarHBondContact O-CD1 3.49Å; A83-N103 PolarHBondContact N-OD1 3.21Å; A83-N103 PolarHBondContact O-ND2 2.81Å; A83-L106 HydrophobicContact CB-CD1 3.52Å; A83-V341 WeakPolarHBondContact CA-O 2.89Å; A83-V341 WeakPolarHBondContact CB-O 3.45Å; A83-L343 HydrophobicContact CB-CD1 4.11Å
84	R	92.9	Very high	92	Very high	108 Å²	108	50.5 Å²	50.5	41%	0.408	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.9	165.2	-74.6	177.7	-170.3	-71.6	-7.6	109	I86 Y95 L99 V340 V341 L343	R84-I86 PolarHBondContact O-N 3.27Å; R84-Y95 PolarHBondContact NH1-OH 3.33Å; R84-L99 HydrophobicContact CG-CD1 4.04Å; R84-V340 HydrophobicContact CB-CG1 4.26Å; R84-V340 HydrophobicContact CG-CG1 3.88Å; R84-V341 PolarHBondContact N-O 3.1Å; R84-V341 VanDerWaalsContact N-O 3.1Å; R84-L343 PolarHBondContact O-N 3.47Å
85	P	90.8	Very high	91.7	Very high	11 Å²	11	53.2 Å²	53.2	7%	0.071	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	131.9	172.4	32.4	-33.9	0	0	0	108.7	F89 Y95 Q98 L99 L343	P85-F89 HydrophobicContact CB-CE1 4.06Å; P85-F89 HydrophobicContact CB-CZ 3.81Å; P85-F89 HydrophobicContact CG-CE1 3.97Å; P85-F89 HydrophobicContact CG-CZ 3.77Å; P85-F89 WeakPolarHBondContact O-CZ 3.41Å; P85-Y95 HydrophobicContact CG-CD2 4.41Å; P85-Y95 HydrophobicContact CG-CE2 4.07Å; P85-Q98 HydrophobicContact CB-CB 4.24Å; P85-Q98 HydrophobicContact CG-CB 3.99Å; P85-L99 HydrophobicContact CG-CB 4.38Å; P85-L343 CarbonylContact C-O 3.58Å; P85-L343 WeakPolarHBondContact CA-O 3.25Å
86	I	87.5	Confident	91.5	Very high	76 Å²	76	55.8 Å²	55.8	39%	0.39	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.5	164.2	-48.1	168.2	0	0	0	107.2	R84 E342 L343 V345	R84-I86 PolarHBondContact O-N 3.27Å; I86-E342 HydrophobicContact CD1-CB 3.62Å; I86-E342 HydrophobicContact CD1-CG 4.24Å; I86-E342 HydrophobicContact CG1-CB 3.79Å; I86-E342 HydrophobicContact CG1-CG 3.96Å; I86-L343 PolarHBondContact N-O 2.86Å; I86-V345 WeakPolarHBondContact O-CG2 3.46Å
87	G	85.3	Confident	91.4	Very high	36 Å²	36	55.6 Å²	55.6	37%	0.371	28%	0.283	S	S	.	.	S	Bend	trans	150.1	-179.3	172.2	0	0	0	0	0	113.2	F89	G87-F89 VanDerWaalsContact O-CD2 3.31Å; G87-F89 WeakPolarHBondContact O-CD2 3.24Å; G87-F89 WeakPolarHBondContact O-CE2 3.06Å
88	D	86.4	Confident	91.2	Very high	172 Å²	172	55.1 Å²	55.1	92%	0.92	28%	0.281	S	S	*	.			trans	-90.1	121.4	169.1	-74.8	-43.5	0	0	0	109.9
89	F	87.7	Confident	91.1	Very high	60 Å²	60	53.7 Å²	53.7	26%	0.263	28%	0.275	S	S	.	.			trans	-106.6	139.9	-178.6	-54.2	-81.2	0	0	0	111.1	P85 G87 S91 Y95 Q98	P85-F89 HydrophobicContact CB-CE1 4.06Å; P85-F89 HydrophobicContact CB-CZ 3.81Å; P85-F89 HydrophobicContact CG-CE1 3.97Å; P85-F89 HydrophobicContact CG-CZ 3.77Å; P85-F89 WeakPolarHBondContact O-CZ 3.41Å; G87-F89 VanDerWaalsContact O-CD2 3.31Å; G87-F89 WeakPolarHBondContact O-CD2 3.24Å; G87-F89 WeakPolarHBondContact O-CE2 3.06Å; F89-S91 VanDerWaalsContact C-N 3.32Å; F89-S91 PolarHBondContact O-N 2.83Å; F89-Y95 HydrophobicContact CD1-CD2 4.09Å; F89-Y95 AromaticContact CD2-CD2 3.57Å; F89-Y95 HydrophobicContact CD2-CD2 3.57Å; F89-Y95 HydrophobicContact CD2-CE2 4.36Å; F89-Y95 HydrophobicContact CD2-CG 4.4Å; F89-Y95 HydrophobicContact CE1-CD2 4.06Å; F89-Y95 AromaticContact CE2-CD2 3.53Å; F89-Y95 HydrophobicContact CE2-CD2 3.53Å; F89-Y95 AromaticContact CE2-CE2 3.93Å; F89-Y95 HydrophobicContact CE2-CE2 3.93Å; F89-Y95 AromaticContact CG-CD2 3.86Å; F89-Y95 HydrophobicContact CG-CD2 3.86Å; F89-Y95 HydrophobicContact CG-CG 4.41Å; F89-Y95 AromaticContact CZ-CD2 3.8Å; F89-Y95 HydrophobicContact CZ-CD2 3.8Å; F89-Y95 HydrophobicContact CZ-CE2 4.17Å; F89-Q98 HydrophobicContact CD1-CB 4.21Å; F89-Q98 HydrophobicContact CD1-CG 3.95Å; F89-Q98 HydrophobicContact CE1-CB 3.76Å; F89-Q98 HydrophobicContact CE1-CG 3.86Å
90	R	84.6	Confident	91.1	Very high	217 Å²	217	53.7 Å²	53.7	82%	0.819	28%	0.275	S	S	*	.	S	Bend	trans	-71.6	-27.4	-174.6	-60.3	173.9	-176.6	175	4	113	D94	R90-D94 HydrophobicContact CB-CB 4.27Å; R90-D94 WeakPolarHBondContact CB-OD2 3.34Å; R90-D94 WeakPolarHBondContact CG-OD2 3.42Å; R90-D94 PolarHBondContact N-OD2 2.94Å
91	S	86.3	Confident	91.2	Very high	54 Å²	54	54.7 Å²	54.7	38%	0.378	28%	0.275	S	S	.	.	S	Bend	trans	-160.7	172.5	-179.7	74.9	0	0	0	0	110.6	F89 A93 D94 Y95	F89-S91 VanDerWaalsContact C-N 3.32Å; F89-S91 PolarHBondContact O-N 2.83Å; S91-A93 VanDerWaalsContact C-N 3.26Å; S91-A93 PolarHBondContact O-N 3.36Å; S91-A93 PolarHBondContact OG-N 2.9Å; S91-D94 PolarHBondContact O-N 3.06Å; S91-D94 PolarHBondContact OG-N 3.44Å; S91-Y95 PolarHBondContact O-N 3.47Å
92	T	87.3	Confident	91.2	Very high	110 Å²	110	52.9 Å²	52.9	68%	0.675	27%	0.268	S	S	*	.	H	α-helix	trans	-60.9	-36.6	169.9	-50.4	0	0	0	0	112	Y95 Q96	T92-Y95 PolarHBondContact O-N 3.41Å; T92-Q96 WeakPolarHBondContact O-CG 3.42Å; T92-Q96 PolarHBondContact O-N 3.48Å
93	A	86.3	Confident	91.4	Very high	16 Å²	16	51.9 Å²	51.9	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-66.1	-43	177.8	0	0	0	0	0	111.6	S91 Y95 Q96 Y97 L297 S299	S91-A93 VanDerWaalsContact C-N 3.26Å; S91-A93 PolarHBondContact O-N 3.36Å; S91-A93 PolarHBondContact OG-N 2.9Å; A93-Y95 PolarHBondContact O-N 2.85Å; A93-Q96 PolarHBondContact O-N 3.41Å; A93-Y97 WeakPolarHBondContact O-CB 3.34Å; A93-Y97 PolarHBondContact O-N 2.69Å; A93-L297 WeakPolarHBondContact CB-O 3.42Å; A93-S299 WeakPolarHBondContact CB-OG 3.47Å
94	D	89.7	Confident	91.6	Very high	21 Å²	21	51.9 Å²	51.9	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-43.8	173.2	-174.2	38.3	0	0	0	110.9	R90 S91 Q96 Y97 Q98	R90-D94 HydrophobicContact CB-CB 4.27Å; R90-D94 WeakPolarHBondContact CB-OD2 3.34Å; R90-D94 WeakPolarHBondContact CG-OD2 3.42Å; R90-D94 PolarHBondContact N-OD2 2.94Å; S91-D94 PolarHBondContact O-N 3.06Å; S91-D94 PolarHBondContact OG-N 3.44Å; D94-Q96 PolarHBondContact O-N 3.48Å; D94-Y97 PolarHBondContact O-N 2.8Å; D94-Q98 WeakPolarHBondContact O-CG 3.35Å; D94-Q98 PolarHBondContact O-N 3.48Å; D94-Q98 PolarHBondContact OD1-NE2 3.38Å
95	Y	93.2	Very high	91.8	Very high	57 Å²	57	48.9 Å²	48.9	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-45.3	173.1	178.1	-104.8	0	0	0	113.1	R84 P85 F89 S91 T92 A93 Y97 Q98 L99	R84-Y95 PolarHBondContact NH1-OH 3.33Å; P85-Y95 HydrophobicContact CG-CD2 4.41Å; P85-Y95 HydrophobicContact CG-CE2 4.07Å; F89-Y95 HydrophobicContact CD1-CD2 4.09Å; F89-Y95 AromaticContact CD2-CD2 3.57Å; F89-Y95 HydrophobicContact CD2-CD2 3.57Å; F89-Y95 HydrophobicContact CD2-CE2 4.36Å; F89-Y95 HydrophobicContact CD2-CG 4.4Å; F89-Y95 HydrophobicContact CE1-CD2 4.06Å; F89-Y95 AromaticContact CE2-CD2 3.53Å; F89-Y95 HydrophobicContact CE2-CD2 3.53Å; F89-Y95 AromaticContact CE2-CE2 3.93Å; F89-Y95 HydrophobicContact CE2-CE2 3.93Å; F89-Y95 AromaticContact CG-CD2 3.86Å; F89-Y95 HydrophobicContact CG-CD2 3.86Å; F89-Y95 HydrophobicContact CG-CG 4.41Å; F89-Y95 AromaticContact CZ-CD2 3.8Å; F89-Y95 HydrophobicContact CZ-CD2 3.8Å; F89-Y95 HydrophobicContact CZ-CE2 4.17Å; S91-Y95 PolarHBondContact O-N 3.47Å; T92-Y95 PolarHBondContact O-N 3.41Å; A93-Y95 PolarHBondContact O-N 2.85Å; Y95-Y97 VanDerWaalsContact C-N 3.31Å; Y95-Y97 PolarHBondContact O-N 3.36Å; Y95-Q98 PolarHBondContact O-N 2.97Å; Y95-L99 HydrophobicContact CE1-CD2 4.27Å; Y95-L99 VanDerWaalsContact O-CB 3.25Å; Y95-L99 WeakPolarHBondContact O-CB 3.45Å; Y95-L99 PolarHBondContact O-N 2.91Å
96	Q	94.1	Very high	92	Very high	74 Å²	74	51.1 Å²	51.1	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-39.5	176.3	-65.4	-52.6	-37.6	0	0	111.5	T92 A93 D94 L99 M100 L297	T92-Q96 WeakPolarHBondContact O-CG 3.42Å; T92-Q96 PolarHBondContact O-N 3.48Å; A93-Q96 PolarHBondContact O-N 3.41Å; D94-Q96 PolarHBondContact O-N 3.48Å; Q96-L99 PolarHBondContact O-N 3.38Å; Q96-M100 WeakPolarHBondContact O-CB 3.27Å; Q96-M100 PolarHBondContact O-N 2.92Å; Q96-L297 HydrophobicContact CB-CD2 4.16Å
97	Y	95.7	Very high	92.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-48.3	175.8	178.6	-101	0	0	0	112.2	A93 D94 Y95 L99 M100 R101 P210 T212 E213 F216 L297	A93-Y97 WeakPolarHBondContact O-CB 3.34Å; A93-Y97 PolarHBondContact O-N 2.69Å; D94-Y97 PolarHBondContact O-N 2.8Å; Y95-Y97 VanDerWaalsContact C-N 3.31Å; Y95-Y97 PolarHBondContact O-N 3.36Å; Y97-L99 VanDerWaalsContact C-N 3.33Å; Y97-L99 PolarHBondContact O-N 3.46Å; Y97-M100 HydrophobicContact CD2-CE 3.63Å; Y97-M100 HydrophobicContact CE2-CE 3.47Å; Y97-M100 VanDerWaalsContact CE2-CE 3.47Å; Y97-M100 PolarHBondContact O-N 2.86Å; Y97-R101 HydrophobicContact CE1-CB 4.43Å; Y97-R101 VanDerWaalsContact O-CB 3.25Å; Y97-R101 WeakPolarHBondContact O-CB 3.44Å; Y97-R101 PolarHBondContact O-N 2.85Å; Y97-P210 PolarHBondContact OH-O 3.02Å; Y97-T212 VanDerWaalsContact CE1-C 3.42Å; Y97-E213 HydrophobicContact CD1-CB 4.35Å; Y97-E213 HydrophobicContact CD2-CB 4.36Å; Y97-E213 HydrophobicContact CG-CB 4.02Å; Y97-E213 HydrophobicContact CG-CG 4.46Å; Y97-F216 HydrophobicContact CD2-CB 4.43Å; Y97-F216 HydrophobicContact CD2-CD1 4.42Å; Y97-F216 HydrophobicContact CE2-CB 3.4Å; Y97-F216 VanDerWaalsContact CE2-CB 3.4Å; Y97-F216 AromaticContact CE2-CD1 3.92Å; Y97-F216 HydrophobicContact CE2-CD1 3.92Å; Y97-F216 HydrophobicContact CE2-CD2 4.24Å; Y97-F216 AromaticContact CE2-CG 3.6Å; Y97-F216 HydrophobicContact CE2-CG 3.6Å; Y97-F216 WeakPolarHBondContact OH-CB 3.32Å; Y97-L297 HydrophobicContact CD2-CD2 4.43Å
98	Q	95.9	Very high	93.1	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.065	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-36.4	177.6	-61.5	-54.7	-25.6	0	0	111.9	P85 F89 D94 Y95 R101 C102 E211	P85-Q98 HydrophobicContact CB-CB 4.24Å; P85-Q98 HydrophobicContact CG-CB 3.99Å; F89-Q98 HydrophobicContact CD1-CB 4.21Å; F89-Q98 HydrophobicContact CD1-CG 3.95Å; F89-Q98 HydrophobicContact CE1-CB 3.76Å; F89-Q98 HydrophobicContact CE1-CG 3.86Å; D94-Q98 WeakPolarHBondContact O-CG 3.35Å; D94-Q98 PolarHBondContact O-N 3.48Å; D94-Q98 PolarHBondContact OD1-NE2 3.38Å; Y95-Q98 PolarHBondContact O-N 2.97Å; Q98-R101 PolarHBondContact O-N 3.47Å; Q98-R101 VanDerWaalsContact OE1-CD 3.29Å; Q98-R101 VanDerWaalsContact OE1-NE 3.12Å; Q98-C102 PolarHBondContact O-N 2.99Å; Q98-C102 PolarHBondContact O-SG 2.83Å; Q98-C102 VanDerWaalsContact O-SG 3.37Å; Q98-E211 PolarHBondContact NE2-O 3.43Å
99	L	95.8	Very high	93.6	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.052	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-42.4	175.4	179.8	65.4	0	0	0	111.9	I81 A83 R84 P85 Y95 Q96 Y97 C102 N103 Y195	I81-L99 HydrophobicContact CG2-CD1 4.41Å; A83-L99 WeakPolarHBondContact O-CD1 3.49Å; R84-L99 HydrophobicContact CG-CD1 4.04Å; P85-L99 HydrophobicContact CG-CB 4.38Å; Y95-L99 HydrophobicContact CE1-CD2 4.27Å; Y95-L99 VanDerWaalsContact O-CB 3.25Å; Y95-L99 WeakPolarHBondContact O-CB 3.45Å; Y95-L99 PolarHBondContact O-N 2.91Å; Q96-L99 PolarHBondContact O-N 3.38Å; Y97-L99 VanDerWaalsContact C-N 3.33Å; Y97-L99 PolarHBondContact O-N 3.46Å; L99-C102 PolarHBondContact O-SG 3.41Å; L99-C102 VanDerWaalsContact O-SG 3.41Å; L99-N103 PolarHBondContact O-N 3.04Å; L99-N103 PolarHBondContact O-ND2 3.42Å; L99-Y195 PolarHBondContact O-OH 2.74Å
100	M	96.9	Very high	94.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-51.8	171.8	178.6	-158	73	0	0	110.9	Q96 Y97 C102 N103 V104 Y195 L209 F216 L297	Q96-M100 WeakPolarHBondContact O-CB 3.27Å; Q96-M100 PolarHBondContact O-N 2.92Å; Y97-M100 HydrophobicContact CD2-CE 3.63Å; Y97-M100 HydrophobicContact CE2-CE 3.47Å; Y97-M100 VanDerWaalsContact CE2-CE 3.47Å; Y97-M100 PolarHBondContact O-N 2.86Å; M100-C102 PolarHBondContact O-N 3.46Å; M100-N103 PolarHBondContact O-N 3.23Å; M100-V104 HydrophobicContact CG-CG2 4.03Å; M100-V104 WeakPolarHBondContact O-CB 3.49Å; M100-V104 VanDerWaalsContact O-CG2 3.28Å; M100-V104 WeakPolarHBondContact O-CG2 3.42Å; M100-V104 PolarHBondContact O-N 3.23Å; M100-Y195 HydrophobicContact CB-CD2 4.35Å; M100-Y195 HydrophobicContact CB-CE1 4.31Å; M100-Y195 HydrophobicContact CB-CE2 3.94Å; M100-Y195 HydrophobicContact CG-CD1 4.09Å; M100-Y195 HydrophobicContact CG-CD2 4Å; M100-Y195 HydrophobicContact CG-CE1 4.2Å; M100-Y195 HydrophobicContact CG-CE2 4.09Å; M100-Y195 HydrophobicContact CG-CG 4Å; M100-L209 HydrophobicContact CE-CD1 4.17Å; M100-F216 HydrophobicContact CE-CE1 4.48Å; M100-F216 HydrophobicContact CE-CE2 4.32Å; M100-F216 HydrophobicContact CE-CZ 4.29Å; M100-L297 HydrophobicContact CE-CD1 4.27Å; M100-L297 HydrophobicContact SD-CD1 3.72Å
101	R	96.8	Very high	94.8	Very high	31 Å²	31	29 Å²	29	12%	0.117	15%	0.152	C	C	.	.	H	α-helix	trans	-52.8	-52.9	-177.6	169.1	175.8	136.8	102.4	1	112.3	Y97 Q98 V104 H105 L209 P210	Y97-R101 HydrophobicContact CE1-CB 4.43Å; Y97-R101 VanDerWaalsContact O-CB 3.25Å; Y97-R101 WeakPolarHBondContact O-CB 3.44Å; Y97-R101 PolarHBondContact O-N 2.85Å; Q98-R101 PolarHBondContact O-N 3.47Å; Q98-R101 VanDerWaalsContact OE1-CD 3.29Å; Q98-R101 VanDerWaalsContact OE1-NE 3.12Å; R101-V104 PolarHBondContact O-N 3.5Å; R101-H105 PolarHBondContact O-CD2 3.04Å; R101-H105 VanDerWaalsContact O-CD2 3.23Å; R101-H105 VanDerWaalsContact O-CG 3.24Å; R101-H105 PolarHBondContact O-N 2.93Å; R101-L209 PolarHBondContact NH1-O 3.31Å; R101-P210 WeakPolarHBondContact CD-O 3.36Å; R101-P210 PolarHBondContact NH1-O 3.23Å
102	C	95.9	Very high	95.4	Very high	21 Å²	21	26.4 Å²	26.4	14%	0.142	13%	0.134	C	C	.	.	H	α-helix	trans	-65.6	-43	-176.8	68.4	0	0	0	0	112.1	Q98 L99 M100 H105 L106	Q98-C102 PolarHBondContact O-N 2.99Å; Q98-C102 PolarHBondContact O-SG 2.83Å; Q98-C102 VanDerWaalsContact O-SG 3.37Å; L99-C102 PolarHBondContact O-SG 3.41Å; L99-C102 VanDerWaalsContact O-SG 3.41Å; M100-C102 PolarHBondContact O-N 3.46Å; C102-H105 PolarHBondContact O-N 3.37Å; C102-L106 WeakPolarHBondContact O-CD1 3.37Å; C102-L106 VanDerWaalsContact O-CG 3.24Å; C102-L106 WeakPolarHBondContact O-CG 3.43Å; C102-L106 PolarHBondContact O-N 2.94Å
103	N	97.6	Very high	96	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.2	-42	178.8	-75.1	-83.7	0	0	0	112	I81 V82 A83 L99 M100 H105 L106 L107 Y195	I81-N103 WeakPolarHBondContact CA-OD1 3.36Å; V82-N103 PolarHBondContact N-OD1 3.39Å; A83-N103 PolarHBondContact N-OD1 3.21Å; A83-N103 PolarHBondContact O-ND2 2.81Å; L99-N103 PolarHBondContact O-N 3.04Å; L99-N103 PolarHBondContact O-ND2 3.42Å; M100-N103 PolarHBondContact O-N 3.23Å; N103-H105 VanDerWaalsContact C-N 3.28Å; N103-H105 PolarHBondContact O-N 2.98Å; N103-L106 PolarHBondContact O-N 2.81Å; N103-L107 HydrophobicContact CB-CD1 4.29Å; N103-L107 VanDerWaalsContact O-CB 3.28Å; N103-L107 WeakPolarHBondContact O-CB 3.43Å; N103-L107 VanDerWaalsContact O-CG 3.29Å; N103-L107 WeakPolarHBondContact O-CG 3.02Å; N103-L107 PolarHBondContact O-N 3.49Å; N103-Y195 HydrophobicContact CB-CE1 4.14Å
104	V	97.8	Very high	96.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-33.5	175.1	170	0	0	0	0	111.4	M100 R101 Y195 Y199 K202 L209	M100-V104 HydrophobicContact CG-CG2 4.03Å; M100-V104 WeakPolarHBondContact O-CB 3.49Å; M100-V104 VanDerWaalsContact O-CG2 3.28Å; M100-V104 WeakPolarHBondContact O-CG2 3.42Å; M100-V104 PolarHBondContact O-N 3.23Å; R101-V104 PolarHBondContact O-N 3.5Å; V104-Y195 HydrophobicContact CG2-CD1 3.89Å; V104-Y195 HydrophobicContact CG2-CE1 4.43Å; V104-Y199 HydrophobicContact CG1-CD1 4.07Å; V104-Y199 HydrophobicContact CG1-CE1 4.29Å; V104-Y199 HydrophobicContact CG1-CG 4.31Å; V104-Y199 HydrophobicContact CG2-CD2 4.16Å; V104-Y199 HydrophobicContact CG2-CE1 4.49Å; V104-Y199 HydrophobicContact CG2-CE2 3.95Å; V104-Y199 HydrophobicContact CG2-CG 4.49Å; V104-K202 HydrophobicContact CG1-CB 4.17Å; V104-K202 HydrophobicContact CG1-CD 3.93Å; V104-K202 WeakPolarHBondContact O-CD 3.42Å; V104-K202 WeakPolarHBondContact O-CE 3.42Å; V104-K202 PolarHBondContact O-NZ 2.82Å; V104-L209 HydrophobicContact CB-CD1 4.09Å; V104-L209 HydrophobicContact CG1-CD1 3.74Å; V104-L209 HydrophobicContact CG1-CG 4.44Å
105	H	95.4	Very high	97	Very high	45 Å²	45	19.4 Å²	19.4	21%	0.208	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-50.5	173	-70.3	-178.5	0	0	0	112	R101 C102 N103 K202 M208 L209	R101-H105 PolarHBondContact O-CD2 3.04Å; R101-H105 VanDerWaalsContact O-CD2 3.23Å; R101-H105 VanDerWaalsContact O-CG 3.24Å; R101-H105 PolarHBondContact O-N 2.93Å; C102-H105 PolarHBondContact O-N 3.37Å; N103-H105 VanDerWaalsContact C-N 3.28Å; N103-H105 PolarHBondContact O-N 2.98Å; H105-K202 PolarHBondContact O-NZ 3.18Å; H105-M208 HydrophobicContact CB-SD 4.29Å; H105-L209 WeakPolarHBondContact NE2-CB 3.25Å; H105-L209 PolarHBondContact NE2-N 3.05Å
106	L	95.3	Very high	97.3	Very high	59 Å²	59	16.8 Å²	16.8	31%	0.309	8%	0.08	S	C	.	.	H	α-helix	trans	-65.8	-38.4	-176.2	-67.5	165.1	0	0	0	113.7	V82 A83 C102 N103 M142 L343	V82-L106 HydrophobicContact CG2-CD1 4.23Å; A83-L106 HydrophobicContact CB-CD1 3.52Å; C102-L106 WeakPolarHBondContact O-CD1 3.37Å; C102-L106 VanDerWaalsContact O-CG 3.24Å; C102-L106 WeakPolarHBondContact O-CG 3.43Å; C102-L106 PolarHBondContact O-N 2.94Å; N103-L106 PolarHBondContact O-N 2.81Å; L106-M142 HydrophobicContact CB-CE 3.99Å; L106-M142 HydrophobicContact CD2-CE 3.93Å; L106-M142 WeakPolarHBondContact O-CE 3.44Å; L106-L343 HydrophobicContact CD1-CD1 3.76Å; L106-L343 HydrophobicContact CD2-CD1 4.22Å; L106-L343 HydrophobicContact CG-CD1 4.48Å
107	L	97.7	Very high	97.5	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	6%	0.064	C	C	.	.	S	Bend	trans	-98.3	157.4	-167.2	-59.2	174.3	0	0	0	112.5	P79 G80 V82 N103 M142 Y199 K202	P79-L107 HydrophobicContact CG-CB 3.98Å; P79-L107 HydrophobicContact CG-CD1 4.24Å; P79-L107 HydrophobicContact CG-CD2 4.03Å; P79-L107 HydrophobicContact CG-CG 4.3Å; G80-L107 WeakPolarHBondContact O-CD1 3.44Å; V82-L107 HydrophobicContact CG1-CD1 4.41Å; V82-L107 HydrophobicContact CG1-CD2 3.95Å; V82-L107 HydrophobicContact CG2-CD1 4.27Å; V82-L107 HydrophobicContact CG2-CD2 3.77Å; V82-L107 HydrophobicContact CG2-CG 4.19Å; N103-L107 HydrophobicContact CB-CD1 4.29Å; N103-L107 VanDerWaalsContact O-CB 3.28Å; N103-L107 WeakPolarHBondContact O-CB 3.43Å; N103-L107 VanDerWaalsContact O-CG 3.29Å; N103-L107 WeakPolarHBondContact O-CG 3.02Å; N103-L107 PolarHBondContact O-N 3.49Å; L107-M142 HydrophobicContact CD2-CB 3.83Å; L107-M142 VanDerWaalsContact CD2-O 3.24Å; L107-M142 WeakPolarHBondContact CD2-O 3.38Å; L107-Y199 WeakPolarHBondContact CB-OH 3.41Å; L107-K202 PolarHBondContact O-NZ 3.04Å
108	K	97.9	Very high	97.6	Very high	92 Å²	92	14.1 Å²	14.1	40%	0.4	7%	0.068	S	C	.	.	P	Polyproline II helix	trans	-100.3	144.7	171.7	-68.2	-174.5	-172	161.4	0	110.6	P79 F136 D141	P79-K108 WeakPolarHBondContact CD-O 3.25Å; K108-F136 HydrophobicContact CB-CD2 3.91Å; K108-F136 HydrophobicContact CB-CE2 3.92Å; K108-D141 WeakPolarHBondContact CD-OD1 3.39Å; K108-D141 WeakPolarHBondContact CD-OD2 3.33Å; K108-D141 WeakPolarHBondContact CE-OD1 3.44Å; K108-D141 IonicContact NZ-OD1 2.9Å; K108-D141 PolarHBondContact NZ-OD1 3.35Å; K108-D141 IonicContact NZ-OD2 3.47Å; K108-D141 PolarHBondContact NZ-OD2 3.36Å
109	L	98.4	Very high	97.7	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.016	9%	0.089	C	C	.	.	P	Polyproline II helix	trans	-68.9	141	172	-169.9	62	0	0	0	110.1	T76 F78 V112 F134 Y199 I203	T76-L109 HydrophobicContact CG2-CD1 4Å; F78-L109 HydrophobicContact CB-CD1 4.39Å; L109-V112 HydrophobicContact CD2-CB 4.44Å; L109-F134 HydrophobicContact CB-CD2 4.22Å; L109-F134 HydrophobicContact CD2-CD2 3.82Å; L109-F134 HydrophobicContact CD2-CE2 3.35Å; L109-F134 HydrophobicContact CD2-CZ 4Å; L109-F134 HydrophobicContact CG-CD2 3.8Å; L109-F134 HydrophobicContact CG-CE2 3.84Å; L109-F134 WeakPolarHBondContact O-CB 3.42Å; L109-Y199 HydrophobicContact CB-CD1 4.07Å; L109-Y199 HydrophobicContact CB-CG 4.46Å; L109-Y199 HydrophobicContact CD1-CD1 4.18Å; L109-Y199 HydrophobicContact CD1-CD2 4.02Å; L109-Y199 HydrophobicContact CD1-CG 3.77Å; L109-I203 HydrophobicContact CB-CD1 4.12Å; L109-I203 HydrophobicContact CD2-CD1 3.43Å; L109-I203 VanDerWaalsContact CD2-CD1 3.43Å; L109-I203 HydrophobicContact CG-CD1 4.44Å
110	I	98.8	Very high	97.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.			trans	-102.7	-49.4	178.9	-71.2	165.5	0	0	0	110.7	E77 P79 F134 F136 I148 L151 I156 F158 L161	E77-I110 WeakPolarHBondContact O-CA 3.28Å; E77-I110 WeakPolarHBondContact O-CB 3.34Å; E77-I110 PolarHBondContact O-N 3.5Å; P79-I110 HydrophobicContact CB-CD1 4.04Å; P79-I110 HydrophobicContact CG-CD1 4.42Å; I110-F134 PolarHBondContact O-N 2.78Å; I110-F136 HydrophobicContact CD1-CD2 4.18Å; I110-F136 HydrophobicContact CD1-CE2 4.05Å; I110-F136 HydrophobicContact CD1-CG 4.5Å; I110-F136 HydrophobicContact CD1-CZ 4.26Å; I110-F136 HydrophobicContact CG1-CB 4.46Å; I110-F136 HydrophobicContact CG1-CD2 3.5Å; I110-F136 HydrophobicContact CG1-CE2 3.8Å; I110-F136 HydrophobicContact CG1-CG 3.93Å; I110-F136 HydrophobicContact CG1-CZ 4.46Å; I110-I148 HydrophobicContact CD1-CD1 4.22Å; I110-L151 HydrophobicContact CD1-CD1 3.61Å; I110-I156 HydrophobicContact CG2-CG2 4.18Å; I110-F158 HydrophobicContact CD1-CE1 3.95Å; I110-F158 HydrophobicContact CD1-CZ 4.14Å; I110-L161 HydrophobicContact CG2-CD1 3.63Å
111	Q	98.8	Very high	97.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	157.3	171.7	-66.6	-177.8	-33.1	0	0	112.9	T76 E77 Q131 F132 N133 I156 A262	T76-Q111 WeakPolarHBondContact CA-O 3.35Å; T76-Q111 WeakPolarHBondContact CB-O 3.25Å; E77-Q111 HydrophobicContact CB-CB 4.08Å; E77-Q111 HydrophobicContact CG-CB 4.38Å; E77-Q111 PolarHBondContact N-O 3.49Å; E77-Q111 PolarHBondContact O-N 3.26Å; Q111-Q131 VanDerWaalsContact NE2-CD 3.31Å; Q111-F132 WeakPolarHBondContact CA-O 3.4Å; Q111-F132 WeakPolarHBondContact CB-O 3.18Å; Q111-N133 PolarHBondContact NE2-OD1 3.16Å; Q111-I156 VanDerWaalsContact CD-CD1 3.43Å; Q111-I156 HydrophobicContact CG-CD1 4.29Å; Q111-I156 VanDerWaalsContact NE2-CD1 3.32Å; Q111-A262 HydrophobicContact CB-CB 3.79Å; Q111-A262 VanDerWaalsContact OE1-N 3.14Å
112	V	98.8	Very high	97.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	139.6	156.4	66.4	0	0	0	0	109.6	M74 D75 T76 L109 F114 F132 F134 F171 M200	M74-V112 HydrophobicContact CG-CG2 4.06Å; M74-V112 HydrophobicContact SD-CG2 4.21Å; D75-V112 WeakPolarHBondContact O-CG2 3.38Å; T76-V112 HydrophobicContact CG2-CB 4.12Å; T76-V112 HydrophobicContact CG2-CG2 3.84Å; L109-V112 HydrophobicContact CD2-CB 4.44Å; V112-F114 HydrophobicContact CG1-CE1 4.37Å; V112-F114 HydrophobicContact CG1-CE2 4.42Å; V112-F114 HydrophobicContact CG1-CZ 4.05Å; V112-F114 HydrophobicContact CG2-CD1 3.96Å; V112-F114 HydrophobicContact CG2-CE1 3.34Å; V112-F114 HydrophobicContact CG2-CZ 3.81Å; V112-F132 HydrophobicContact CG1-CB 3.86Å; V112-F132 HydrophobicContact CG1-CD2 3.95Å; V112-F132 HydrophobicContact CG1-CG 4.18Å; V112-F132 PolarHBondContact N-O 2.83Å; V112-F132 PolarHBondContact O-N 3.09Å; V112-F134 HydrophobicContact CB-CE2 4.15Å; V112-F134 HydrophobicContact CG1-CE2 3.67Å; V112-F134 HydrophobicContact CG1-CZ 3.8Å; V112-F171 HydrophobicContact CG1-CE2 4.14Å; V112-F171 HydrophobicContact CG1-CZ 3.72Å; V112-M200 HydrophobicContact CG2-SD 4.16Å
113	G	98.8	Very high	97.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.4	174.8	0	0	0	0	0	110.6	M74 D75 W130 A262 S266	M74-G113 WeakPolarHBondContact CA-O 3.45Å; D75-G113 PolarHBondContact N-O 2.98Å; D75-G113 PolarHBondContact O-N 3.36Å; G113-W130 WeakPolarHBondContact CA-O 3.46Å; G113-A262 WeakPolarHBondContact CA-O 3.47Å; G113-A262 VanDerWaalsContact N-CB 3.26Å; G113-S266 WeakPolarHBondContact O-CB 3.45Å
114	F	98.9	Very high	97.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.6	171.4	-60.4	-34.4	0	0	0	110	M62 I72 A73 M74 V112 F116 T129 W130 F132 F171 L175 W188 M200	M62-F114 HydrophobicContact CE-CB 4.22Å; M62-F114 HydrophobicContact CE-CD2 3.64Å; M62-F114 HydrophobicContact CE-CG 4.44Å; I72-F114 HydrophobicContact CG2-CB 3.96Å; I72-F114 HydrophobicContact CG2-CD1 4.3Å; I72-F114 HydrophobicContact CG2-CG 4.3Å; A73-F114 WeakPolarHBondContact O-CA 3.29Å; M74-F114 HydrophobicContact CB-CD1 4.16Å; M74-F114 HydrophobicContact CB-CE1 4.42Å; M74-F114 HydrophobicContact CG-CD1 3.64Å; M74-F114 HydrophobicContact CG-CE1 3.49Å; M74-F114 VanDerWaalsContact CG-CE1 3.49Å; V112-F114 HydrophobicContact CG1-CE1 4.37Å; V112-F114 HydrophobicContact CG1-CE2 4.42Å; V112-F114 HydrophobicContact CG1-CZ 4.05Å; V112-F114 HydrophobicContact CG2-CD1 3.96Å; V112-F114 HydrophobicContact CG2-CE1 3.34Å; V112-F114 HydrophobicContact CG2-CZ 3.81Å; F114-F116 HydrophobicContact CB-CE2 3.87Å; F114-F116 HydrophobicContact CB-CZ 4.39Å; F114-T129 CarbonylContact O-C 3.53Å; F114-T129 VanDerWaalsContact O-CA 3.3Å; F114-T129 WeakPolarHBondContact O-CA 3.18Å; F114-W130 PolarHBondContact N-O 3.24Å; F114-W130 PolarHBondContact O-N 3.03Å; F114-F132 HydrophobicContact CD2-CD2 4.2Å; F114-F132 AromaticContact CD2-CE2 3.53Å; F114-F132 HydrophobicContact CD2-CE2 3.53Å; F114-F132 HydrophobicContact CD2-CZ 4.29Å; F114-F132 HydrophobicContact CE2-CD2 4.4Å; F114-F132 AromaticContact CE2-CE2 3.94Å; F114-F132 HydrophobicContact CE2-CE2 3.94Å; F114-F132 HydrophobicContact CG-CE2 4.38Å; F114-F171 HydrophobicContact CE2-CE2 4.16Å; F114-F171 AromaticContact CE2-CZ 3.77Å; F114-F171 HydrophobicContact CE2-CZ 3.77Å; F114-F171 AromaticContact CZ-CZ 3.86Å; F114-F171 HydrophobicContact CZ-CZ 3.86Å; F114-L175 HydrophobicContact CE2-CD1 4.14Å; F114-L175 HydrophobicContact CE2-CD2 4.05Å; F114-L175 HydrophobicContact CZ-CD2 4.1Å; F114-W188 HydrophobicContact CD1-CH2 4.2Å; F114-W188 AromaticContact CD1-CZ3 3.84Å; F114-W188 HydrophobicContact CD1-CZ3 3.84Å; F114-W188 AromaticContact CE1-CH2 3.92Å; F114-W188 HydrophobicContact CE1-CH2 3.92Å; F114-W188 AromaticContact CE1-CZ3 3.66Å; F114-W188 HydrophobicContact CE1-CZ3 3.66Å; F114-W188 HydrophobicContact CZ-CH2 4.19Å; F114-W188 HydrophobicContact CZ-CZ3 4.37Å; F114-M200 HydrophobicContact CE1-CE 4.38Å; F114-M200 HydrophobicContact CE1-SD 4.49Å; F114-M200 HydrophobicContact CZ-CE 3.77Å; F114-M200 HydrophobicContact CZ-SD 4.17Å
115	S	98.9	Very high	97.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.2	-179.6	-67.8	0	0	0	0	111	I72 A73 F117 T129 S266 L267	I72-S115 CarbonylContact C-O 3.58Å; I72-S115 WeakPolarHBondContact CA-O 3.4Å; A73-S115 PolarHBondContact N-O 2.96Å; A73-S115 PolarHBondContact O-N 3.33Å; S115-F117 WeakPolarHBondContact O-CD2 3.32Å; S115-F117 WeakPolarHBondContact O-CE2 3.13Å; S115-T129 WeakPolarHBondContact CB-OG1 3.23Å; S115-T129 WeakPolarHBondContact OG-CB 3.45Å; S115-T129 WeakPolarHBondContact OG-CG2 3.44Å; S115-T129 PolarHBondContact OG-OG1 2.97Å; S115-S266 PolarHBondContact OG-OG 3.02Å; S115-L267 VanDerWaalsContact OG-CA 3.24Å; S115-L267 WeakPolarHBondContact OG-CA 3.34Å; S115-L267 WeakPolarHBondContact OG-CB 3.17Å; S115-L267 PolarHBondContact OG-N 2.74Å; S115-L267 VanDerWaalsContact OG-N 3.11Å
116	F	98.8	Very high	97.6	Very high	1 Å²	1	39 Å²	39	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	138.2	-168.8	-70.6	-100.4	0	0	0	112.4	M62 V65 V66 V71 I72 F114 P124 S128 W130 L180	M62-F116 HydrophobicContact CB-CZ 4.27Å; M62-F116 HydrophobicContact CE-CE2 3.77Å; M62-F116 HydrophobicContact CE-CZ 3.76Å; M62-F116 HydrophobicContact CG-CE2 4.28Å; M62-F116 HydrophobicContact CG-CZ 4.35Å; V65-F116 HydrophobicContact CG1-CB 3.86Å; V65-F116 HydrophobicContact CG1-CD1 3.84Å; V65-F116 HydrophobicContact CG1-CG 3.81Å; V66-F116 HydrophobicContact CB-CE1 4.11Å; V66-F116 HydrophobicContact CG2-CE1 4.32Å; V71-F116 CarbonylContact O-C 3.57Å; I72-F116 HydrophobicContact CD1-CD1 4.42Å; I72-F116 HydrophobicContact CD1-CE1 3.61Å; I72-F116 HydrophobicContact CD1-CZ 3.99Å; I72-F116 HydrophobicContact CG1-CD1 4Å; I72-F116 HydrophobicContact CG1-CE1 3.67Å; I72-F116 HydrophobicContact CG1-CZ 4.21Å; I72-F116 HydrophobicContact CG2-CZ 4.38Å; F114-F116 HydrophobicContact CB-CE2 3.87Å; F114-F116 HydrophobicContact CB-CZ 4.39Å; F116-P124 HydrophobicContact CB-CG 3.89Å; F116-P124 WeakPolarHBondContact O-CD 3.5Å; F116-S128 PolarHBondContact N-O 3.04Å; F116-W130 AromaticContact CD2-CE3 3.61Å; F116-W130 HydrophobicContact CD2-CE3 3.61Å; F116-W130 AromaticContact CD2-CZ3 3.5Å; F116-W130 HydrophobicContact CD2-CZ3 3.5Å; F116-W130 AromaticContact CE2-CE3 3.64Å; F116-W130 HydrophobicContact CE2-CE3 3.64Å; F116-W130 AromaticContact CE2-CZ3 3.91Å; F116-W130 HydrophobicContact CE2-CZ3 3.91Å; F116-W130 HydrophobicContact CG-CZ3 4.3Å; F116-L180 HydrophobicContact CE1-CD2 4.27Å; F116-L180 HydrophobicContact CE1-CG 4.35Å; F116-L180 HydrophobicContact CZ-CD2 3.74Å; F116-L180 HydrophobicContact CZ-CG 4.32Å
117	F	98.8	Very high	97.7	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	156.4	-179.5	-54.2	-101	0	0	0	111.6	Y69 V71 A73 S115 R122 R123 L267 F274	Y69-F117 CarbonylContact C-O 3.53Å; Y69-F117 WeakPolarHBondContact CA-O 3.34Å; V71-F117 HydrophobicContact CB-CB 4.15Å; V71-F117 WeakPolarHBondContact CB-O 3.24Å; V71-F117 PolarHBondContact N-O 2.95Å; V71-F117 PolarHBondContact O-N 2.89Å; A73-F117 HydrophobicContact CB-CD2 4.46Å; A73-F117 HydrophobicContact CB-CE2 3.85Å; S115-F117 WeakPolarHBondContact O-CD2 3.32Å; S115-F117 WeakPolarHBondContact O-CE2 3.13Å; F117-R122 CarbonylContact C-O 3.49Å; F117-R122 VanDerWaalsContact CA-O 3.27Å; F117-R122 WeakPolarHBondContact CA-O 3.48Å; F117-R123 HydrophobicContact CD1-CG 3.62Å; F117-R123 HydrophobicContact CE1-CG 3.53Å; F117-R123 HydrophobicContact CZ-CG 4.34Å; F117-L267 HydrophobicContact CZ-CD1 4.01Å; F117-F274 HydrophobicContact CB-CE2 3.61Å; F117-F274 HydrophobicContact CB-CZ 4.03Å; F117-F274 HydrophobicContact CD1-CD2 4.11Å; F117-F274 AromaticContact CD1-CE2 3.88Å; F117-F274 HydrophobicContact CD1-CE2 3.88Å; F117-F274 HydrophobicContact CD2-CE2 4.28Å; F117-F274 HydrophobicContact CG-CD2 4.36Å; F117-F274 AromaticContact CG-CE2 3.69Å; F117-F274 HydrophobicContact CG-CE2 3.69Å
118	T	98.4	Very high	97.7	Very high	15 Å²	15	36.5 Å²	36.5	9%	0.092	19%	0.19	C	C	.	.			trans	-75.8	167.3	161.4	62.8	0	0	0	0	110.9	Y69 D120 G121 R122 F274	Y69-T118 HydrophobicContact CD1-CG2 3.52Å; Y69-T118 HydrophobicContact CE1-CG2 3.66Å; Y69-T118 HydrophobicContact CG-CG2 4.41Å; T118-D120 WeakPolarHBondContact CB-OD1 3.42Å; T118-D120 PolarHBondContact O-N 2.6Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-OD1 3.47Å; T118-G121 PolarHBondContact O-N 2.86Å; T118-G121 PolarHBondContact OG1-N 3.27Å; T118-R122 HydrophobicContact CG2-CB 4.28Å; T118-R122 PolarHBondContact N-O 2.83Å; T118-R122 PolarHBondContact OG1-N 3.08Å; T118-R122 PolarHBondContact OG1-O 3.02Å; T118-F274 VanDerWaalsContact O-CZ 3.23Å; T118-F274 WeakPolarHBondContact O-CZ 3.43Å
119	H	97.1	Very high	97.8	Very high	108 Å²	108	32.1 Å²	32.1	50%	0.5	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.4	175.1	-65.9	-64.3	0	0	0	115	P70 V71 F274 K277	P70-H119 WeakPolarHBondContact CG-NE2 3.5Å; V71-H119 WeakPolarHBondContact CG2-ND1 3.43Å; H119-F274 WeakPolarHBondContact O-CE1 3.2Å; H119-K277 PolarHBondContact O-NZ 3.37Å
120	D	96.2	Very high	97.8	Very high	98 Å²	98	32 Å²	32	52%	0.524	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	10.7	172.4	66	-51	0	0	0	113.9	T118 R122	T118-D120 WeakPolarHBondContact CB-OD1 3.42Å; T118-D120 PolarHBondContact O-N 2.6Å; T118-D120 VanDerWaalsContact O-N 3.1Å; T118-D120 PolarHBondContact OG1-OD1 3.47Å; D120-R122 IonicContact OD1-CZ 2.67Å; D120-R122 IonicContact OD1-NE 2.75Å; D120-R122 IonicContact OD1-NH2 2.92Å; D120-R122 PolarHBondContact OD1-NH2 2.87Å; D120-R122 IonicContact OD2-CZ 3.15Å; D120-R122 IonicContact OD2-NE 3.67Å; D120-R122 PolarHBondContact OD2-NE 3.45Å; D120-R122 IonicContact OD2-NH2 3.75Å; D120-R122 PolarHBondContact OD2-NH2 3.47Å
121	G	97.6	Very high	97.8	Very high	24 Å²	24	32.1 Å²	32.1	25%	0.247	17%	0.171	C	C	.	.	S	Bend	trans	84.4	11.9	169.1	0	0	0	0	0	116.3	T118	T118-G121 PolarHBondContact O-N 2.86Å; T118-G121 PolarHBondContact OG1-N 3.27Å
122	R	97.7	Very high	97.8	Very high	156 Å²	156	32.1 Å²	32.1	59%	0.589	17%	0.171	S	C	*	.	P	Polyproline II helix	trans	-82.5	136.4	173.6	-70.1	178.3	-74.3	142.4	7.1	110.6	F117 T118 D120	F117-R122 CarbonylContact C-O 3.49Å; F117-R122 VanDerWaalsContact CA-O 3.27Å; F117-R122 WeakPolarHBondContact CA-O 3.48Å; T118-R122 HydrophobicContact CG2-CB 4.28Å; T118-R122 PolarHBondContact N-O 2.83Å; T118-R122 PolarHBondContact OG1-N 3.08Å; T118-R122 PolarHBondContact OG1-O 3.02Å; D120-R122 IonicContact OD1-CZ 2.67Å; D120-R122 IonicContact OD1-NE 2.75Å; D120-R122 IonicContact OD1-NH2 2.92Å; D120-R122 PolarHBondContact OD1-NH2 2.87Å; D120-R122 IonicContact OD2-CZ 3.15Å; D120-R122 IonicContact OD2-NE 3.67Å; D120-R122 PolarHBondContact OD2-NE 3.45Å; D120-R122 IonicContact OD2-NH2 3.75Å; D120-R122 PolarHBondContact OD2-NH2 3.47Å
123	R	97.6	Very high	97.8	Very high	103 Å²	103	32.4 Å²	32.4	39%	0.389	17%	0.172	S	C	.	.	P	Polyproline II helix	trans	-86.8	155.5	176.6	-67.3	-174.7	-68.4	155.3	-7.1	111.9	Y69 F117 S128	Y69-R123 VanDerWaalsContact CE1-C 3.48Å; F117-R123 HydrophobicContact CD1-CG 3.62Å; F117-R123 HydrophobicContact CE1-CG 3.53Å; F117-R123 HydrophobicContact CZ-CG 4.34Å; R123-S128 PolarHBondContact NH1-OG 3.45Å
124	P	96.7	Very high	97.8	Very high	10 Å²	10	32.4 Å²	32.4	7%	0.065	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-53.6	144.9	164.6	-22.3	29	0	0	0	112.2	V65 Y69 F116	V65-P124 HydrophobicContact CG1-CB 4.43Å; V65-P124 HydrophobicContact CG1-CG 3.64Å; Y69-P124 HydrophobicContact CD1-CG 3.8Å; Y69-P124 HydrophobicContact CD2-CB 4.31Å; Y69-P124 HydrophobicContact CD2-CG 3.79Å; Y69-P124 HydrophobicContact CE1-CB 4.36Å; Y69-P124 HydrophobicContact CE1-CG 4.1Å; Y69-P124 HydrophobicContact CE2-CB 4.13Å; Y69-P124 HydrophobicContact CE2-CG 4.1Å; Y69-P124 HydrophobicContact CG-CG 3.66Å; F116-P124 HydrophobicContact CB-CG 3.89Å; F116-P124 WeakPolarHBondContact O-CD 3.5Å
125	P	93.8	Very high	97.8	Very high	104 Å²	104	35 Å²	35	68%	0.675	19%	0.191	S	C	*	.	S	Bend	trans	-72.8	134.8	171.1	30.3	-33.8	0	0	0	110.8	Y69	Y69-P125 WeakPolarHBondContact OH-CD 3.48Å
126	G	94.9	Very high	97.7	Very high	42 Å²	42	35.1 Å²	35.1	43%	0.433	19%	0.191	S	C	.	.	S	Bend	trans	86.1	-122.8	-175.1	0	0	0	0	0	111	G46 S128	G46-G126 VanDerWaalsContact CA-O 3.31Å; G46-G126 WeakPolarHBondContact CA-O 3.37Å; G126-S128 PolarHBondContact O-N 2.94Å
127	I	97.4	Very high	97.7	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.021	20%	0.195	C	C	.	.			trans	-72.3	121	175.7	-54.8	-53.8	0	0	0	109.7	E43 R48 W130	E43-I127 HydrophobicContact CB-CD1 4.07Å; E43-I127 HydrophobicContact CG-CD1 4.48Å; R48-I127 HydrophobicContact CB-CD1 4.11Å; R48-I127 HydrophobicContact CB-CG1 4.23Å; R48-I127 HydrophobicContact CB-CG2 3.51Å; I127-W130 HydrophobicContact CB-CH2 4.31Å; I127-W130 HydrophobicContact CB-CZ2 4.15Å; I127-W130 HydrophobicContact CG2-CD2 4.05Å; I127-W130 HydrophobicContact CG2-CE3 4.29Å; I127-W130 HydrophobicContact CG2-CH2 3.75Å; I127-W130 HydrophobicContact CG2-CZ2 3.5Å; I127-W130 VanDerWaalsContact CG2-CZ2 3.5Å; I127-W130 HydrophobicContact CG2-CZ3 4.15Å
128	S	97.9	Very high	97.6	Very high	2 Å²	2	38 Å²	38	1%	0.014	21%	0.207	C	C	.	.			trans	-115.5	-13.9	176.7	58.1	0	0	0	0	113.4	G46 F116 R123 G126	G46-S128 PolarHBondContact O-N 3.35Å; G46-S128 PolarHBondContact O-OG 3.27Å; F116-S128 PolarHBondContact N-O 3.04Å; R123-S128 PolarHBondContact NH1-OG 3.45Å; G126-S128 PolarHBondContact O-N 2.94Å
129	T	98.8	Very high	97.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	136.4	-171.5	-62	0	0	0	0	110.1	G46 I47 R48 F114 S115 G263	G46-T129 PolarHBondContact O-N 2.9Å; I47-T129 CarbonylContact C-O 2.97Å; I47-T129 WeakPolarHBondContact CA-O 3.41Å; I47-T129 HydrophobicContact CB-CG2 4.49Å; I47-T129 HydrophobicContact CG1-CG2 4.01Å; I47-T129 HydrophobicContact CG2-CG2 4.24Å; R48-T129 PolarHBondContact N-O 3.39Å; F114-T129 CarbonylContact O-C 3.53Å; F114-T129 VanDerWaalsContact O-CA 3.3Å; F114-T129 WeakPolarHBondContact O-CA 3.18Å; S115-T129 WeakPolarHBondContact CB-OG1 3.23Å; S115-T129 WeakPolarHBondContact OG-CB 3.45Å; S115-T129 WeakPolarHBondContact OG-CG2 3.44Å; S115-T129 PolarHBondContact OG-OG1 2.97Å; T129-G263 WeakPolarHBondContact CG2-O 3.35Å
130	W	98.8	Very high	97.4	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.7	174.4	-73.8	-99.1	0	0	0	109.9	R48 V50 E58 M62 V65 G113 F114 F116 I127 F132	R48-W130 WeakPolarHBondContact O-CA 3.4Å; V50-W130 HydrophobicContact CG2-CB 4.04Å; V50-W130 HydrophobicContact CG2-CG 4.3Å; E58-W130 PolarHBondContact OE2-NE1 3.05Å; M62-W130 HydrophobicContact CE-CB 4.21Å; M62-W130 HydrophobicContact CE-CD2 4.48Å; M62-W130 HydrophobicContact CE-CG 4.31Å; M62-W130 HydrophobicContact CG-CD2 3.5Å; M62-W130 VanDerWaalsContact CG-CD2 3.5Å; M62-W130 HydrophobicContact CG-CE3 3.81Å; M62-W130 HydrophobicContact CG-CG 3.95Å; M62-W130 HydrophobicContact CG-CH2 4.27Å; M62-W130 HydrophobicContact CG-CZ2 3.95Å; M62-W130 HydrophobicContact CG-CZ3 4.19Å; M62-W130 HydrophobicContact SD-CB 3.91Å; M62-W130 HydrophobicContact SD-CD2 3.75Å; M62-W130 HydrophobicContact SD-CE3 4.36Å; M62-W130 HydrophobicContact SD-CG 3.51Å; M62-W130 VanDerWaalsContact SD-CG 3.51Å; V65-W130 HydrophobicContact CG1-CH2 4.45Å; V65-W130 HydrophobicContact CG2-CH2 3.98Å; G113-W130 WeakPolarHBondContact CA-O 3.46Å; F114-W130 PolarHBondContact N-O 3.24Å; F114-W130 PolarHBondContact O-N 3.03Å; F116-W130 AromaticContact CD2-CE3 3.61Å; F116-W130 HydrophobicContact CD2-CE3 3.61Å; F116-W130 AromaticContact CD2-CZ3 3.5Å; F116-W130 HydrophobicContact CD2-CZ3 3.5Å; F116-W130 AromaticContact CE2-CE3 3.64Å; F116-W130 HydrophobicContact CE2-CE3 3.64Å; F116-W130 AromaticContact CE2-CZ3 3.91Å; F116-W130 HydrophobicContact CE2-CZ3 3.91Å; F116-W130 HydrophobicContact CG-CZ3 4.3Å; I127-W130 HydrophobicContact CB-CH2 4.31Å; I127-W130 HydrophobicContact CB-CZ2 4.15Å; I127-W130 HydrophobicContact CG2-CD2 4.05Å; I127-W130 HydrophobicContact CG2-CE3 4.29Å; I127-W130 HydrophobicContact CG2-CH2 3.75Å; I127-W130 HydrophobicContact CG2-CZ2 3.5Å; I127-W130 VanDerWaalsContact CG2-CZ2 3.5Å; I127-W130 HydrophobicContact CG2-CZ3 4.15Å; W130-F132 HydrophobicContact CB-CD2 4.38Å; W130-F132 HydrophobicContact CB-CE2 3.69Å; W130-F132 HydrophobicContact CB-CZ 4.17Å
131	Q	98.7	Very high	97.5	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	105.8	178.2	178.6	165.6	-82.7	0	0	108.9	I47 R48 D49 V50 Q111 N133	I47-Q131 HydrophobicContact CG2-CB 4.25Å; R48-Q131 PolarHBondContact O-N 3.46Å; D49-Q131 PolarHBondContact OD1-NE2 3.22Å; V50-Q131 PolarHBondContact N-O 3.21Å; Q111-Q131 VanDerWaalsContact NE2-CD 3.31Å; Q131-N133 PolarHBondContact O-ND2 3.39Å
132	F	98.9	Very high	97.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.5	-178.9	-63.6	-96.8	0	0	0	110.2	V50 L55 I59 M62 Q111 V112 F114 W130 F134 I166 F171	V50-F132 HydrophobicContact CB-CD1 3.71Å; V50-F132 HydrophobicContact CB-CE1 4.05Å; V50-F132 HydrophobicContact CB-CG 4.18Å; V50-F132 HydrophobicContact CG1-CD1 3.77Å; V50-F132 HydrophobicContact CG1-CE1 3.83Å; V50-F132 HydrophobicContact CG2-CD1 4.05Å; V50-F132 HydrophobicContact CG2-CE1 4.03Å; V50-F132 HydrophobicContact CG2-CG 4.35Å; V50-F132 HydrophobicContact CG2-CZ 4.29Å; L55-F132 HydrophobicContact CD1-CD1 3.94Å; L55-F132 HydrophobicContact CD1-CE1 3.9Å; I59-F132 HydrophobicContact CD1-CE1 4.13Å; I59-F132 HydrophobicContact CG1-CE1 3.93Å; I59-F132 HydrophobicContact CG1-CZ 4.17Å; M62-F132 HydrophobicContact CE-CE2 3.79Å; M62-F132 HydrophobicContact CE-CZ 3.64Å; M62-F132 HydrophobicContact SD-CE2 4.16Å; M62-F132 HydrophobicContact SD-CZ 3.57Å; M62-F132 VanDerWaalsContact SD-CZ 3.57Å; Q111-F132 WeakPolarHBondContact CA-O 3.4Å; Q111-F132 WeakPolarHBondContact CB-O 3.18Å; V112-F132 HydrophobicContact CG1-CB 3.86Å; V112-F132 HydrophobicContact CG1-CD2 3.95Å; V112-F132 HydrophobicContact CG1-CG 4.18Å; V112-F132 PolarHBondContact N-O 2.83Å; V112-F132 PolarHBondContact O-N 3.09Å; F114-F132 HydrophobicContact CD2-CD2 4.2Å; F114-F132 AromaticContact CD2-CE2 3.53Å; F114-F132 HydrophobicContact CD2-CE2 3.53Å; F114-F132 HydrophobicContact CD2-CZ 4.29Å; F114-F132 HydrophobicContact CE2-CD2 4.4Å; F114-F132 AromaticContact CE2-CE2 3.94Å; F114-F132 HydrophobicContact CE2-CE2 3.94Å; F114-F132 HydrophobicContact CG-CE2 4.38Å; W130-F132 HydrophobicContact CB-CD2 4.38Å; W130-F132 HydrophobicContact CB-CE2 3.69Å; W130-F132 HydrophobicContact CB-CZ 4.17Å; F132-F134 HydrophobicContact CB-CE2 4.28Å; F132-F134 HydrophobicContact CB-CZ 4.18Å; F132-I166 HydrophobicContact CB-CD1 4.01Å; F132-I166 HydrophobicContact CD1-CD1 3.9Å; F132-I166 HydrophobicContact CG-CD1 4.46Å; F132-F171 HydrophobicContact CB-CE2 4.34Å; F132-F171 AromaticContact CD1-CD2 3.72Å; F132-F171 HydrophobicContact CD1-CD2 3.72Å; F132-F171 AromaticContact CD1-CE2 3.57Å; F132-F171 HydrophobicContact CD1-CE2 3.57Å; F132-F171 HydrophobicContact CD2-CE2 4.06Å; F132-F171 AromaticContact CE1-CD2 3.98Å; F132-F171 HydrophobicContact CE1-CD2 3.98Å; F132-F171 AromaticContact CE1-CE2 3.74Å; F132-F171 HydrophobicContact CE1-CE2 3.74Å; F132-F171 HydrophobicContact CE2-CE2 4.23Å; F132-F171 HydrophobicContact CG-CD2 4.24Å; F132-F171 AromaticContact CG-CE2 3.73Å; F132-F171 HydrophobicContact CG-CE2 3.73Å; F132-F171 HydrophobicContact CZ-CE2 4.06Å
133	N	98.8	Very high	97.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.027	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.6	-178.4	-62.9	-81.3	0	0	0	109.7	D49 V50 W51 Q111 Q131 L161 G165 I166	D49-N133 PolarHBondContact OD1-ND2 3Å; V50-N133 PolarHBondContact O-N 3.49Å; V50-N133 PolarHBondContact O-ND2 3.4Å; W51-N133 HydrophobicContact CD2-CB 3.92Å; W51-N133 HydrophobicContact CE3-CB 3.68Å; W51-N133 HydrophobicContact CH2-CB 3.51Å; W51-N133 HydrophobicContact CZ2-CB 3.75Å; W51-N133 VanDerWaalsContact CZ2-CG 3.41Å; W51-N133 WeakPolarHBondContact CZ2-ND2 3.31Å; W51-N133 HydrophobicContact CZ3-CB 3.47Å; W51-N133 VanDerWaalsContact CZ3-CB 3.47Å; Q111-N133 PolarHBondContact NE2-OD1 3.16Å; Q131-N133 PolarHBondContact O-ND2 3.39Å; N133-L161 HydrophobicContact CB-CD2 3.8Å; N133-G165 WeakPolarHBondContact O-CA 2.97Å; N133-I166 WeakPolarHBondContact O-CB 3.37Å; N133-I166 WeakPolarHBondContact O-CG1 3.23Å; N133-I166 PolarHBondContact O-N 2.99Å
134	F	98.8	Very high	97.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-87.9	158	-174.7	-66	-73	0	0	0	113.4	L109 I110 V112 F132 F136 L161 I166 T168 F171	L109-F134 HydrophobicContact CB-CD2 4.22Å; L109-F134 HydrophobicContact CD2-CD2 3.82Å; L109-F134 HydrophobicContact CD2-CE2 3.35Å; L109-F134 HydrophobicContact CD2-CZ 4Å; L109-F134 HydrophobicContact CG-CD2 3.8Å; L109-F134 HydrophobicContact CG-CE2 3.84Å; L109-F134 WeakPolarHBondContact O-CB 3.42Å; I110-F134 PolarHBondContact O-N 2.78Å; V112-F134 HydrophobicContact CB-CE2 4.15Å; V112-F134 HydrophobicContact CG1-CE2 3.67Å; V112-F134 HydrophobicContact CG1-CZ 3.8Å; F132-F134 HydrophobicContact CB-CE2 4.28Å; F132-F134 HydrophobicContact CB-CZ 4.18Å; F134-F136 PolarHBondContact O-N 3.06Å; F134-L161 WeakPolarHBondContact O-CD2 3.37Å; F134-I166 HydrophobicContact CD1-CB 3.89Å; F134-I166 HydrophobicContact CD1-CG2 3.86Å; F134-I166 HydrophobicContact CE1-CB 4.31Å; F134-I166 HydrophobicContact CE1-CG2 3.9Å; F134-T168 HydrophobicContact CD1-CG2 3.74Å; F134-T168 HydrophobicContact CE1-CG2 4.11Å; F134-T168 HydrophobicContact CG-CG2 4.27Å; F134-F171 HydrophobicContact CE1-CB 3.85Å; F134-F171 AromaticContact CE1-CD1 3.98Å; F134-F171 HydrophobicContact CE1-CD1 3.98Å; F134-F171 HydrophobicContact CE1-CD2 4.04Å; F134-F171 AromaticContact CE1-CG 3.71Å; F134-F171 HydrophobicContact CE1-CG 3.71Å; F134-F171 AromaticContact CZ-CD1 3.95Å; F134-F171 HydrophobicContact CZ-CD1 3.95Å; F134-F171 HydrophobicContact CZ-CD2 4.04Å; F134-F171 HydrophobicContact CZ-CE1 4.01Å; F134-F171 HydrophobicContact CZ-CE2 4.11Å; F134-F171 AromaticContact CZ-CG 3.95Å; F134-F171 HydrophobicContact CZ-CG 3.95Å; F134-F171 HydrophobicContact CZ-CZ 4.08Å
135	S	98.6	Very high	97.3	Very high	56 Å²	56	40.1 Å²	40.1	39%	0.392	24%	0.235	S	C	.	.			trans	-70.8	121.1	175.7	-172.7	0	0	0	0	111	L161 I166	S135-L161 WeakPolarHBondContact CA-O 3.34Å; S135-I166 PolarHBondContact N-O 3.14Å
136	F	98.5	Very high	97.4	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	22%	0.221	C	C	.	.			trans	-141.6	138.8	-177.8	-162.5	-85.1	0	0	0	109.5	P79 K108 I110 F134 L138 D141 Y143 I148 F158 L161 Q162	P79-F136 HydrophobicContact CB-CE2 4.33Å; P79-F136 HydrophobicContact CB-CZ 3.99Å; P79-F136 HydrophobicContact CG-CE2 3.87Å; P79-F136 HydrophobicContact CG-CZ 3.96Å; K108-F136 HydrophobicContact CB-CD2 3.91Å; K108-F136 HydrophobicContact CB-CE2 3.92Å; I110-F136 HydrophobicContact CD1-CD2 4.18Å; I110-F136 HydrophobicContact CD1-CE2 4.05Å; I110-F136 HydrophobicContact CD1-CG 4.5Å; I110-F136 HydrophobicContact CD1-CZ 4.26Å; I110-F136 HydrophobicContact CG1-CB 4.46Å; I110-F136 HydrophobicContact CG1-CD2 3.5Å; I110-F136 HydrophobicContact CG1-CE2 3.8Å; I110-F136 HydrophobicContact CG1-CG 3.93Å; I110-F136 HydrophobicContact CG1-CZ 4.46Å; F134-F136 PolarHBondContact O-N 3.06Å; F136-L138 HydrophobicContact CD1-CD2 4.5Å; F136-L138 HydrophobicContact CE1-CD2 4.06Å; F136-D141 HydrophobicContact CD1-CB 4.42Å; F136-D141 HydrophobicContact CE1-CB 3.91Å; F136-D141 HydrophobicContact CE2-CB 4.04Å; F136-D141 HydrophobicContact CZ-CB 3.69Å; F136-Y143 HydrophobicContact CE1-CD1 4.43Å; F136-I148 HydrophobicContact CE1-CD1 4.33Å; F136-F158 AromaticContact CD1-CD1 3.98Å; F136-F158 HydrophobicContact CD1-CD1 3.98Å; F136-F158 AromaticContact CD1-CE1 3.93Å; F136-F158 HydrophobicContact CD1-CE1 3.93Å; F136-F158 HydrophobicContact CE1-CE1 4.24Å; F136-L161 HydrophobicContact CB-CB 4.28Å; F136-L161 HydrophobicContact CB-CD1 4.21Å; F136-Q162 VanDerWaalsContact O-CA 3.29Å; F136-Q162 WeakPolarHBondContact O-CA 3.29Å; F136-Q162 WeakPolarHBondContact O-CB 3.49Å; F136-Q162 PolarHBondContact O-N 3.26Å
137	N	97.9	Very high	97.4	Very high	17 Å²	17	38.1 Å²	38.1	9%	0.091	21%	0.211	C	C	.	.			trans	-129.1	109.3	-176.9	-177.6	-6	0	0	0	111.2	A139 E140 D141 Q162	N137-A139 PolarHBondContact O-N 2.8Å; N137-A139 WeakPolarHBondContact OD1-CB 3.26Å; N137-A139 PolarHBondContact OD1-N 3.47Å; N137-E140 HydrophobicContact CB-CB 4.21Å; N137-E140 WeakPolarHBondContact ND2-CG 3.35Å; N137-E140 PolarHBondContact ND2-OE2 3.23Å; N137-E140 PolarHBondContact O-N 3.14Å; N137-D141 PolarHBondContact N-OD2 2.81Å; N137-D141 WeakPolarHBondContact O-CB 3.47Å; N137-D141 PolarHBondContact O-N 3.34Å; N137-Q162 HydrophobicContact CB-CG 4.21Å; N137-Q162 PolarHBondContact ND2-NE2 3.27Å; N137-Q162 VanDerWaalsContact ND2-NE2 3.17Å; N137-Q162 PolarHBondContact OD1-NE2 3.09Å
138	L	96.9	Very high	97.4	Very high	50 Å²	50	38.3 Å²	38.3	26%	0.262	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-12	-179.8	-70.7	172.5	0	0	0	114.8	F136 Y143 I148 F158	F136-L138 HydrophobicContact CD1-CD2 4.5Å; F136-L138 HydrophobicContact CE1-CD2 4.06Å; L138-Y143 HydrophobicContact CB-CE1 4.47Å; L138-Y143 HydrophobicContact CD2-CD1 4Å; L138-Y143 HydrophobicContact CD2-CE1 3.79Å; L138-Y143 WeakPolarHBondContact O-CE1 3.49Å; L138-I148 HydrophobicContact CD1-CG2 4.48Å; L138-I148 HydrophobicContact CD2-CD1 3.98Å; L138-I148 HydrophobicContact CD2-CG1 4.03Å; L138-I148 HydrophobicContact CD2-CG2 3.74Å; L138-F158 HydrophobicContact CD1-CB 3.66Å; L138-F158 HydrophobicContact CD1-CD1 3.96Å; L138-F158 HydrophobicContact CD1-CD2 4.47Å; L138-F158 HydrophobicContact CD1-CG 3.77Å; L138-F158 HydrophobicContact CD2-CD1 3.94Å; L138-F158 HydrophobicContact CD2-CE1 4.14Å; L138-F158 HydrophobicContact CG-CB 4.25Å; L138-F158 HydrophobicContact CG-CD1 3.83Å; L138-F158 HydrophobicContact CG-CG 4.18Å
139	A	96.3	Very high	97.3	Very high	92 Å²	92	41.5 Å²	41.5	76%	0.76	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-15.1	175.2	0	0	0	0	0	113.9	N137	N137-A139 PolarHBondContact O-N 2.8Å; N137-A139 WeakPolarHBondContact OD1-CB 3.26Å; N137-A139 PolarHBondContact OD1-N 3.47Å
140	E	95.7	Very high	97.2	Very high	150 Å²	150	45.3 Å²	45.3	70%	0.701	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-33.1	-173.8	-68.9	173.2	168.1	0	0	113	N137	N137-E140 HydrophobicContact CB-CB 4.21Å; N137-E140 WeakPolarHBondContact ND2-CG 3.35Å; N137-E140 PolarHBondContact ND2-OE2 3.23Å; N137-E140 PolarHBondContact O-N 3.14Å
141	D	97.2	Very high	97.1	Very high	22 Å²	22	45.4 Å²	45.4	12%	0.118	25%	0.247	C	C	.	.	S	Bend	trans	-90.6	140.8	-172.1	-67.9	-40.1	0	0	0	112.4	K108 F136 N137 Y143	K108-D141 WeakPolarHBondContact CD-OD1 3.39Å; K108-D141 WeakPolarHBondContact CD-OD2 3.33Å; K108-D141 WeakPolarHBondContact CE-OD1 3.44Å; K108-D141 IonicContact NZ-OD1 2.9Å; K108-D141 PolarHBondContact NZ-OD1 3.35Å; K108-D141 IonicContact NZ-OD2 3.47Å; K108-D141 PolarHBondContact NZ-OD2 3.36Å; F136-D141 HydrophobicContact CD1-CB 4.42Å; F136-D141 HydrophobicContact CE1-CB 3.91Å; F136-D141 HydrophobicContact CE2-CB 4.04Å; F136-D141 HydrophobicContact CZ-CB 3.69Å; N137-D141 PolarHBondContact N-OD2 2.81Å; N137-D141 WeakPolarHBondContact O-CB 3.47Å; N137-D141 PolarHBondContact O-N 3.34Å; D141-Y143 WeakPolarHBondContact O-CD1 3.43Å
142	M	96.3	Very high	97	Very high	100 Å²	100	50 Å²	50	49%	0.493	27%	0.268	S	S	.	.			trans	-71	143.6	173.5	-70.5	179.5	-78.7	0	0	111.3	L106 L107	L106-M142 HydrophobicContact CB-CE 3.99Å; L106-M142 HydrophobicContact CD2-CE 3.93Å; L106-M142 WeakPolarHBondContact O-CE 3.44Å; L107-M142 HydrophobicContact CD2-CB 3.83Å; L107-M142 VanDerWaalsContact CD2-O 3.24Å; L107-M142 WeakPolarHBondContact CD2-O 3.38Å
143	Y	97.2	Very high	96.9	Very high	85 Å²	85	57.2 Å²	57.2	33%	0.333	30%	0.3	S	S	.	.			trans	-157.9	156.1	176.2	55	-99.6	0	0	0	113.6	P79 V82 F136 L138 D141 I148	P79-Y143 VanDerWaalsContact CB-CB 3.49Å; V82-Y143 VanDerWaalsContact CG1-C 3.4Å; F136-Y143 HydrophobicContact CE1-CD1 4.43Å; L138-Y143 HydrophobicContact CB-CE1 4.47Å; L138-Y143 HydrophobicContact CD2-CD1 4Å; L138-Y143 HydrophobicContact CD2-CE1 3.79Å; L138-Y143 WeakPolarHBondContact O-CE1 3.49Å; D141-Y143 WeakPolarHBondContact O-CD1 3.43Å; Y143-I148 HydrophobicContact CD1-CG1 4.21Å; Y143-I148 HydrophobicContact CD2-CB 4.32Å; Y143-I148 HydrophobicContact CD2-CD1 4.43Å; Y143-I148 HydrophobicContact CD2-CG1 3.38Å; Y143-I148 HydrophobicContact CE2-CG1 4.08Å; Y143-I148 HydrophobicContact CG-CD1 4.04Å; Y143-I148 HydrophobicContact CG-CG1 3.47Å; Y143-I148 VanDerWaalsContact CG-CG1 3.47Å
144	A	96.6	Very high	96.7	Very high	22 Å²	22	57.9 Å²	57.9	18%	0.182	31%	0.305	C	S	.	.			trans	-79.5	126.6	162.6	0	0	0	0	0	109.8	P79 V82 D146 S147 I148	P79-A144 WeakPolarHBondContact O-CB 3.43Å; P79-A144 PolarHBondContact O-N 2.9Å; V82-A144 HydrophobicContact CG1-CB 4.32Å; A144-D146 VanDerWaalsContact C-N 3.34Å; A144-D146 PolarHBondContact O-N 2.7Å; A144-S147 WeakPolarHBondContact O-CB 2.94Å; A144-S147 PolarHBondContact O-N 3.43Å; A144-S147 VanDerWaalsContact O-N 3.16Å; A144-I148 PolarHBondContact O-N 3.23Å
145	H	94.9	Very high	96.6	Very high	87 Å²	87	60.2 Å²	60.2	40%	0.403	33%	0.328	S	S	.	.	H	α-helix	trans	-58.1	-43.3	-173.8	-175.2	69.2	0	0	0	113	S147 I148 Q149	H145-S147 VanDerWaalsContact C-N 3.31Å; H145-S147 PolarHBondContact O-N 2.79Å; H145-I148 PolarHBondContact O-N 3.19Å; H145-Q149 PolarHBondContact CD2-NE2 3.19Å; H145-Q149 PolarHBondContact NE2-NE2 3.19Å; H145-Q149 PolarHBondContact O-N 2.93Å
146	D	95.7	Very high	96.5	Very high	72 Å²	72	58.1 Å²	58.1	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-66.6	-32.9	-179.1	-65	-5.3	0	0	0	112	A144 Q149 L150	A144-D146 VanDerWaalsContact C-N 3.34Å; A144-D146 PolarHBondContact O-N 2.7Å; D146-Q149 PolarHBondContact O-N 3Å; D146-L150 WeakPolarHBondContact O-CB 3.43Å; D146-L150 PolarHBondContact O-N 3.02Å
147	S	95.7	Very high	96.5	Very high	32 Å²	32	62 Å²	62	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-68.1	-43.4	175.4	-60.7	0	0	0	0	111.9	G80 A144 H145 L150 L151	G80-S147 WeakPolarHBondContact CA-OG 3.43Å; A144-S147 WeakPolarHBondContact O-CB 2.94Å; A144-S147 PolarHBondContact O-N 3.43Å; A144-S147 VanDerWaalsContact O-N 3.16Å; H145-S147 VanDerWaalsContact C-N 3.31Å; H145-S147 PolarHBondContact O-N 2.79Å; S147-L150 PolarHBondContact O-N 2.76Å; S147-L151 VanDerWaalsContact O-CG 3.32Å; S147-L151 WeakPolarHBondContact O-CG 3.21Å; S147-L151 PolarHBondContact O-N 3Å
148	I	97.1	Very high	96.5	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-43.4	173.8	-60.7	-55.2	0	0	0	110.8	P79 I110 F136 L138 Y143 A144 H145 L150 L151 Q152 F158	P79-I148 HydrophobicContact CB-CD1 4.05Å; I110-I148 HydrophobicContact CD1-CD1 4.22Å; F136-I148 HydrophobicContact CE1-CD1 4.33Å; L138-I148 HydrophobicContact CD1-CG2 4.48Å; L138-I148 HydrophobicContact CD2-CD1 3.98Å; L138-I148 HydrophobicContact CD2-CG1 4.03Å; L138-I148 HydrophobicContact CD2-CG2 3.74Å; Y143-I148 HydrophobicContact CD1-CG1 4.21Å; Y143-I148 HydrophobicContact CD2-CB 4.32Å; Y143-I148 HydrophobicContact CD2-CD1 4.43Å; Y143-I148 HydrophobicContact CD2-CG1 3.38Å; Y143-I148 HydrophobicContact CE2-CG1 4.08Å; Y143-I148 HydrophobicContact CG-CD1 4.04Å; Y143-I148 HydrophobicContact CG-CG1 3.47Å; Y143-I148 VanDerWaalsContact CG-CG1 3.47Å; A144-I148 PolarHBondContact O-N 3.23Å; H145-I148 PolarHBondContact O-N 3.19Å; I148-L150 VanDerWaalsContact C-N 3.29Å; I148-L150 PolarHBondContact O-N 3.06Å; I148-L151 PolarHBondContact O-N 3.09Å; I148-Q152 HydrophobicContact CG2-CG 4.22Å; I148-Q152 WeakPolarHBondContact O-CB 3.3Å; I148-Q152 VanDerWaalsContact O-CG 3.31Å; I148-Q152 WeakPolarHBondContact O-CG 3.31Å; I148-Q152 PolarHBondContact O-N 2.86Å; I148-F158 HydrophobicContact CD1-CE1 3.73Å; I148-F158 HydrophobicContact CD1-CZ 3.68Å; I148-F158 HydrophobicContact CG2-CE2 4.24Å; I148-F158 HydrophobicContact CG2-CZ 4.17Å
149	Q	96.7	Very high	96.5	Very high	70 Å²	70	65 Å²	65	33%	0.327	35%	0.349	S	S	.	.	H	α-helix	trans	-60.1	-38.4	175.7	-76.3	-161.1	25.5	0	0	112.9	H145 D146 K153	H145-Q149 PolarHBondContact CD2-NE2 3.19Å; H145-Q149 PolarHBondContact NE2-NE2 3.19Å; H145-Q149 PolarHBondContact O-N 2.93Å; D146-Q149 PolarHBondContact O-N 3Å; Q149-K153 VanDerWaalsContact O-CD 3.27Å; Q149-K153 WeakPolarHBondContact O-CD 3.34Å; Q149-K153 WeakPolarHBondContact O-CG 3.47Å; Q149-K153 PolarHBondContact O-N 2.9Å; Q149-K153 VanDerWaalsContact OE1-NZ 3.07Å
150	L	96.2	Very high	96.6	Very high	79 Å²	79	64.7 Å²	64.7	41%	0.414	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-54.9	176.2	-179.6	62.3	0	0	0	109.9	D146 S147 I148 Q152 K153 S154	D146-L150 WeakPolarHBondContact O-CB 3.43Å; D146-L150 PolarHBondContact O-N 3.02Å; S147-L150 PolarHBondContact O-N 2.76Å; I148-L150 VanDerWaalsContact C-N 3.29Å; I148-L150 PolarHBondContact O-N 3.06Å; L150-Q152 VanDerWaalsContact C-N 3.33Å; L150-Q152 PolarHBondContact O-N 2.69Å; L150-K153 WeakPolarHBondContact O-CA 3.43Å; L150-K153 WeakPolarHBondContact O-CB 3.16Å; L150-K153 PolarHBondContact O-N 3.34Å; L150-S154 PolarHBondContact O-N 2.82Å; L150-S154 PolarHBondContact O-OG 2.91Å
151	L	97.2	Very high	96.7	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-40.4	-179.1	-69	173.5	0	0	0	113	E77 I110 S147 I148 K153 S154 G155 I156 F158	E77-L151 HydrophobicContact CB-CD2 3.88Å; E77-L151 HydrophobicContact CG-CD2 3.94Å; E77-L151 WeakPolarHBondContact OE2-CD2 3.38Å; I110-L151 HydrophobicContact CD1-CD1 3.61Å; S147-L151 VanDerWaalsContact O-CG 3.32Å; S147-L151 WeakPolarHBondContact O-CG 3.21Å; S147-L151 PolarHBondContact O-N 3Å; I148-L151 PolarHBondContact O-N 3.09Å; L151-K153 PolarHBondContact O-N 3.21Å; L151-S154 CarbonylContact O-C 3.58Å; L151-S154 PolarHBondContact O-N 3.05Å; L151-G155 PolarHBondContact O-N 3.29Å; L151-I156 HydrophobicContact CB-CB 4.2Å; L151-I156 HydrophobicContact CB-CG1 3.91Å; L151-I156 HydrophobicContact CD2-CG1 4.15Å; L151-I156 WeakPolarHBondContact O-CB 3.14Å; L151-I156 WeakPolarHBondContact O-CG1 3.43Å; L151-I156 PolarHBondContact O-N 3.32Å; L151-F158 HydrophobicContact CB-CE2 4.05Å; L151-F158 HydrophobicContact CB-CZ 4.04Å; L151-F158 HydrophobicContact CD1-CZ 4.27Å
152	Q	96.3	Very high	96.8	Very high	98 Å²	98	61.1 Å²	61.1	46%	0.458	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-42.8	173.2	-75.6	178.2	-24.4	0	0	112.1	I148 L150 S154 G155 F158	I148-Q152 HydrophobicContact CG2-CG 4.22Å; I148-Q152 WeakPolarHBondContact O-CB 3.3Å; I148-Q152 VanDerWaalsContact O-CG 3.31Å; I148-Q152 WeakPolarHBondContact O-CG 3.31Å; I148-Q152 PolarHBondContact O-N 2.86Å; L150-Q152 VanDerWaalsContact C-N 3.33Å; L150-Q152 PolarHBondContact O-N 2.69Å; Q152-S154 VanDerWaalsContact C-N 3.3Å; Q152-S154 PolarHBondContact O-N 3.16Å; Q152-G155 PolarHBondContact O-N 3.04Å; Q152-F158 HydrophobicContact CG-CD2 3.63Å; Q152-F158 HydrophobicContact CG-CE2 3.62Å
153	K	96.6	Very high	96.9	Very high	152 Å²	152	64 Å²	64	66%	0.661	32%	0.317	S	S	*	.	H	α-helix	trans	-67	-31.4	176	-70.1	162.7	-167.8	158.9	0	112.2	Q149 L150 L151 G155	Q149-K153 VanDerWaalsContact O-CD 3.27Å; Q149-K153 WeakPolarHBondContact O-CD 3.34Å; Q149-K153 WeakPolarHBondContact O-CG 3.47Å; Q149-K153 PolarHBondContact O-N 2.9Å; Q149-K153 VanDerWaalsContact OE1-NZ 3.07Å; L150-K153 WeakPolarHBondContact O-CA 3.43Å; L150-K153 WeakPolarHBondContact O-CB 3.16Å; L150-K153 PolarHBondContact O-N 3.34Å; L151-K153 PolarHBondContact O-N 3.21Å; K153-G155 PolarHBondContact O-N 2.98Å
154	S	94.9	Very high	96.9	Very high	20 Å²	20	62.5 Å²	62.5	14%	0.14	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-5.6	174.4	-49.7	0	0	0	0	113.8	L150 L151 Q152 Q259 H260 Q261	L150-S154 PolarHBondContact O-N 2.82Å; L150-S154 PolarHBondContact O-OG 2.91Å; L151-S154 CarbonylContact O-C 3.58Å; L151-S154 PolarHBondContact O-N 3.05Å; Q152-S154 VanDerWaalsContact C-N 3.3Å; Q152-S154 PolarHBondContact O-N 3.16Å; S154-Q259 WeakPolarHBondContact CB-O 3.48Å; S154-H260 VanDerWaalsContact CB-O 3.24Å; S154-H260 WeakPolarHBondContact CB-O 3.47Å; S154-H260 WeakPolarHBondContact OG-CB 3.25Å; S154-Q261 PolarHBondContact O-NE2 3.09Å
155	G	96.3	Very high	97	Very high	48 Å²	48	61.8 Å²	61.8	50%	0.495	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	20.1	174.8	0	0	0	0	0	115.5	L151 Q152 K153 D157 Q261	L151-G155 PolarHBondContact O-N 3.29Å; Q152-G155 PolarHBondContact O-N 3.04Å; K153-G155 PolarHBondContact O-N 2.98Å; G155-D157 PolarHBondContact O-N 3.23Å; G155-Q261 PolarHBondContact O-NE2 2.82Å
156	I	97	Very high	97.2	Very high	12 Å²	12	57.7 Å²	57.7	6%	0.062	29%	0.29	C	S	.	.			trans	-74.6	116.9	171.7	-58.5	-59.1	0	0	0	110.5	I110 Q111 L151 F158 L161 Q261	I110-I156 HydrophobicContact CG2-CG2 4.18Å; Q111-I156 VanDerWaalsContact CD-CD1 3.43Å; Q111-I156 HydrophobicContact CG-CD1 4.29Å; Q111-I156 VanDerWaalsContact NE2-CD1 3.32Å; L151-I156 HydrophobicContact CB-CB 4.2Å; L151-I156 HydrophobicContact CB-CG1 3.91Å; L151-I156 HydrophobicContact CD2-CG1 4.15Å; L151-I156 WeakPolarHBondContact O-CB 3.14Å; L151-I156 WeakPolarHBondContact O-CG1 3.43Å; L151-I156 PolarHBondContact O-N 3.32Å; I156-F158 HydrophobicContact CB-CD2 4.32Å; I156-F158 HydrophobicContact CB-CE2 3.89Å; I156-F158 HydrophobicContact CG2-CD2 3.84Å; I156-F158 HydrophobicContact CG2-CE1 4.47Å; I156-F158 HydrophobicContact CG2-CE2 3.56Å; I156-F158 HydrophobicContact CG2-CG 4.42Å; I156-F158 HydrophobicContact CG2-CZ 3.91Å; I156-F158 WeakPolarHBondContact O-CD2 3.18Å; I156-F158 PolarHBondContact O-N 2.82Å; I156-L161 HydrophobicContact CG2-CD1 3.59Å; I156-L161 HydrophobicContact CG2-CG 4.29Å; I156-Q261 HydrophobicContact CD1-CG 3.84Å
157	D	97	Very high	97.3	Very high	83 Å²	83	57.3 Å²	57.3	44%	0.444	29%	0.293	S	S	.	.			trans	-85.7	90.7	176.3	-179.5	-10.6	0	0	0	110.5	G155 D159 R160 L161	G155-D157 PolarHBondContact O-N 3.23Å; D157-D159 VanDerWaalsContact C-N 3.34Å; D157-D159 PolarHBondContact O-N 3.27Å; D157-D159 PolarHBondContact OD1-N 3.43Å; D157-R160 HydrophobicContact CB-CB 3.96Å; D157-R160 PolarHBondContact O-N 2.84Å; D157-R160 WeakPolarHBondContact OD1-CB 3.44Å; D157-R160 PolarHBondContact OD1-N 3.2Å; D157-R160 VanDerWaalsContact OD2-CB 3.27Å; D157-R160 WeakPolarHBondContact OD2-CB 3.13Å; D157-L161 WeakPolarHBondContact O-CG 3.32Å; D157-L161 PolarHBondContact O-N 2.69Å
158	F	97.8	Very high	97.5	Very high	11 Å²	11	58.6 Å²	58.6	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-31.2	-177.9	-78.4	-91	0	0	0	113.9	I110 F136 L138 I148 L151 Q152 I156 R160 L161 Q162	I110-F158 HydrophobicContact CD1-CE1 3.95Å; I110-F158 HydrophobicContact CD1-CZ 4.14Å; F136-F158 AromaticContact CD1-CD1 3.98Å; F136-F158 HydrophobicContact CD1-CD1 3.98Å; F136-F158 AromaticContact CD1-CE1 3.93Å; F136-F158 HydrophobicContact CD1-CE1 3.93Å; F136-F158 HydrophobicContact CE1-CE1 4.24Å; L138-F158 HydrophobicContact CD1-CB 3.66Å; L138-F158 HydrophobicContact CD1-CD1 3.96Å; L138-F158 HydrophobicContact CD1-CD2 4.47Å; L138-F158 HydrophobicContact CD1-CG 3.77Å; L138-F158 HydrophobicContact CD2-CD1 3.94Å; L138-F158 HydrophobicContact CD2-CE1 4.14Å; L138-F158 HydrophobicContact CG-CB 4.25Å; L138-F158 HydrophobicContact CG-CD1 3.83Å; L138-F158 HydrophobicContact CG-CG 4.18Å; I148-F158 HydrophobicContact CD1-CE1 3.73Å; I148-F158 HydrophobicContact CD1-CZ 3.68Å; I148-F158 HydrophobicContact CG2-CE2 4.24Å; I148-F158 HydrophobicContact CG2-CZ 4.17Å; L151-F158 HydrophobicContact CB-CE2 4.05Å; L151-F158 HydrophobicContact CB-CZ 4.04Å; L151-F158 HydrophobicContact CD1-CZ 4.27Å; Q152-F158 HydrophobicContact CG-CD2 3.63Å; Q152-F158 HydrophobicContact CG-CE2 3.62Å; I156-F158 HydrophobicContact CB-CD2 4.32Å; I156-F158 HydrophobicContact CB-CE2 3.89Å; I156-F158 HydrophobicContact CG2-CD2 3.84Å; I156-F158 HydrophobicContact CG2-CE1 4.47Å; I156-F158 HydrophobicContact CG2-CE2 3.56Å; I156-F158 HydrophobicContact CG2-CG 4.42Å; I156-F158 HydrophobicContact CG2-CZ 3.91Å; I156-F158 WeakPolarHBondContact O-CD2 3.18Å; I156-F158 PolarHBondContact O-N 2.82Å; F158-R160 VanDerWaalsContact C-N 3.28Å; F158-R160 PolarHBondContact O-N 3.17Å; F158-L161 HydrophobicContact CD1-CD1 3.87Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; F158-L161 HydrophobicContact CG-CD1 4.31Å; F158-L161 PolarHBondContact O-N 3.44Å; F158-Q162 PolarHBondContact O-N 3.44Å
159	D	97.8	Very high	97.5	Very high	118 Å²	118	65.8 Å²	65.8	63%	0.631	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-38	175.3	-66.2	-15.5	0	0	0	110.2	D157 R163	D157-D159 VanDerWaalsContact C-N 3.34Å; D157-D159 PolarHBondContact O-N 3.27Å; D157-D159 PolarHBondContact OD1-N 3.43Å; D159-R163 WeakPolarHBondContact O-CB 3.16Å; D159-R163 PolarHBondContact O-N 3.04Å; D159-R163 VanDerWaalsContact O-N 3.1Å
160	R	98.3	Very high	97.6	Very high	86 Å²	86	66.3 Å²	66.3	33%	0.325	33%	0.332	S	S	.	.	H	α-helix	trans	-73.2	-35.3	173.5	-168.5	-179.3	179.7	-171.1	-4.5	113	W51 D157 F158 Q162 R163 D164 G165	W51-R160 VanDerWaalsContact CE2-CZ 3.41Å; W51-R160 HydrophobicContact CE3-CG 4.15Å; W51-R160 HydrophobicContact CH2-CB 4.16Å; W51-R160 HydrophobicContact CH2-CG 3.64Å; W51-R160 HydrophobicContact CZ2-CG 4.22Å; W51-R160 HydrophobicContact CZ3-CB 4.24Å; W51-R160 HydrophobicContact CZ3-CG 3.6Å; W51-R160 VanDerWaalsContact NE1-NH2 3.14Å; D157-R160 HydrophobicContact CB-CB 3.96Å; D157-R160 PolarHBondContact O-N 2.84Å; D157-R160 WeakPolarHBondContact OD1-CB 3.44Å; D157-R160 PolarHBondContact OD1-N 3.2Å; D157-R160 VanDerWaalsContact OD2-CB 3.27Å; D157-R160 WeakPolarHBondContact OD2-CB 3.13Å; F158-R160 VanDerWaalsContact C-N 3.28Å; F158-R160 PolarHBondContact O-N 3.17Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 2.84Å; R160-R163 PolarHBondContact O-N 3.41Å; R160-D164 HydrophobicContact CG-CB 4.17Å; R160-D164 WeakPolarHBondContact CG-OD2 3.14Å; R160-D164 WeakPolarHBondContact O-CA 3.28Å; R160-D164 WeakPolarHBondContact O-CB 3.39Å; R160-D164 PolarHBondContact O-N 2.94Å; R160-G165 PolarHBondContact O-N 3.35Å
161	L	98.5	Very high	97.7	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-46.8	170.1	-65.4	-179	0	0	0	110.8	W51 I110 N133 F134 S135 F136 I156 D157 F158 R163 G165	W51-L161 HydrophobicContact CH2-CD2 4.05Å; W51-L161 HydrophobicContact CZ3-CD2 3.98Å; I110-L161 HydrophobicContact CG2-CD1 3.63Å; N133-L161 HydrophobicContact CB-CD2 3.8Å; F134-L161 WeakPolarHBondContact O-CD2 3.37Å; S135-L161 WeakPolarHBondContact CA-O 3.34Å; F136-L161 HydrophobicContact CB-CB 4.28Å; F136-L161 HydrophobicContact CB-CD1 4.21Å; I156-L161 HydrophobicContact CG2-CD1 3.59Å; I156-L161 HydrophobicContact CG2-CG 4.29Å; D157-L161 WeakPolarHBondContact O-CG 3.32Å; D157-L161 PolarHBondContact O-N 2.69Å; F158-L161 HydrophobicContact CD1-CD1 3.87Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; F158-L161 HydrophobicContact CG-CD1 4.31Å; F158-L161 PolarHBondContact O-N 3.44Å; L161-R163 PolarHBondContact O-N 2.85Å; L161-G165 VanDerWaalsContact O-CA 3.25Å; L161-G165 WeakPolarHBondContact O-CA 3.17Å; L161-G165 PolarHBondContact O-N 3.34Å
162	Q	98.2	Very high	97.8	Very high	96 Å²	96	62.7 Å²	62.7	45%	0.449	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-44.7	178.8	-168.7	-178.8	9.6	0	0	112	F136 N137 F158 R160	F136-Q162 VanDerWaalsContact O-CA 3.29Å; F136-Q162 WeakPolarHBondContact O-CA 3.29Å; F136-Q162 WeakPolarHBondContact O-CB 3.49Å; F136-Q162 PolarHBondContact O-N 3.26Å; N137-Q162 HydrophobicContact CB-CG 4.21Å; N137-Q162 PolarHBondContact ND2-NE2 3.27Å; N137-Q162 VanDerWaalsContact ND2-NE2 3.17Å; N137-Q162 PolarHBondContact OD1-NE2 3.09Å; F158-Q162 PolarHBondContact O-N 3.44Å; R160-Q162 VanDerWaalsContact C-N 3.33Å; R160-Q162 PolarHBondContact O-N 2.84Å
163	R	98.1	Very high	97.8	Very high	162 Å²	162	62.1 Å²	62.1	61%	0.611	31%	0.311	S	S	*	.	H	α-helix	trans	-78.9	-47.9	-175.1	-172.5	-176.4	62.4	-126.7	-9	114.4	D159 R160 L161	D159-R163 WeakPolarHBondContact O-CB 3.16Å; D159-R163 PolarHBondContact O-N 3.04Å; D159-R163 VanDerWaalsContact O-N 3.1Å; R160-R163 PolarHBondContact O-N 3.41Å; L161-R163 PolarHBondContact O-N 2.85Å
164	D	98.6	Very high	97.9	Very high	53 Å²	53	55 Å²	55	28%	0.283	28%	0.28	S	S	.	.	H	α-helix	trans	-116.1	-3.1	-165	-57.6	-43.3	0	0	0	113.3	W51 K52 R160	W51-D164 HydrophobicContact CE3-CB 3.89Å; W51-D164 HydrophobicContact CZ3-CB 4.5Å; K52-D164 VanDerWaalsContact CB-O 3.23Å; K52-D164 WeakPolarHBondContact CB-O 3.22Å; K52-D164 PolarHBondContact N-O 3.27Å; R160-D164 HydrophobicContact CG-CB 4.17Å; R160-D164 WeakPolarHBondContact CG-OD2 3.14Å; R160-D164 WeakPolarHBondContact O-CA 3.28Å; R160-D164 WeakPolarHBondContact O-CB 3.39Å; R160-D164 PolarHBondContact O-N 2.94Å
165	G	98.7	Very high	98.1	Very high	6 Å²	6	54 Å²	54	6%	0.062	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-64.7	154.1	-174.7	0	0	0	0	0	114.9	N133 R160 L161	N133-G165 WeakPolarHBondContact O-CA 2.97Å; R160-G165 PolarHBondContact O-N 3.35Å; L161-G165 VanDerWaalsContact O-CA 3.25Å; L161-G165 WeakPolarHBondContact O-CA 3.17Å; L161-G165 PolarHBondContact O-N 3.34Å
166	I	98.8	Very high	98.2	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-74.5	137.8	-177.6	-66.9	157.6	0	0	0	111.2	V50 L55 F132 N133 F134 S135 F171	V50-I166 HydrophobicContact CB-CD1 4.27Å; V50-I166 HydrophobicContact CG1-CD1 4.13Å; V50-I166 WeakPolarHBondContact O-CD1 3.35Å; L55-I166 HydrophobicContact CD1-CD1 3.93Å; L55-I166 HydrophobicContact CD1-CG1 4.24Å; L55-I166 HydrophobicContact CD1-CG2 4.11Å; L55-I166 HydrophobicContact CD2-CG1 4.44Å; L55-I166 HydrophobicContact CD2-CG2 3.73Å; F132-I166 HydrophobicContact CB-CD1 4.01Å; F132-I166 HydrophobicContact CD1-CD1 3.9Å; F132-I166 HydrophobicContact CG-CD1 4.46Å; N133-I166 WeakPolarHBondContact O-CB 3.37Å; N133-I166 WeakPolarHBondContact O-CG1 3.23Å; N133-I166 PolarHBondContact O-N 2.99Å; F134-I166 HydrophobicContact CD1-CB 3.89Å; F134-I166 HydrophobicContact CD1-CG2 3.86Å; F134-I166 HydrophobicContact CE1-CB 4.31Å; F134-I166 HydrophobicContact CE1-CG2 3.9Å; S135-I166 PolarHBondContact N-O 3.14Å; I166-F171 HydrophobicContact CG2-CB 3.81Å
167	S	98.4	Very high	98.2	Very high	64 Å²	64	59.4 Å²	59.4	45%	0.448	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-73.2	123.2	163.7	174.2	0	0	0	0	109.9	F169 K170 F171	S167-F169 PolarHBondContact O-N 3.02Å; S167-K170 PolarHBondContact O-N 3.3Å; S167-F171 PolarHBondContact O-N 2.7Å
168	T	98.2	Very high	98.2	Very high	59 Å²	59	55.8 Å²	55.8	36%	0.362	28%	0.276	S	S	.	.	H	α-helix	trans	-56.3	-36	176.4	49.8	0	0	0	0	112.6	F134 F171 A172 I203	F134-T168 HydrophobicContact CD1-CG2 3.74Å; F134-T168 HydrophobicContact CE1-CG2 4.11Å; F134-T168 HydrophobicContact CG-CG2 4.27Å; T168-F171 PolarHBondContact O-N 2.63Å; T168-A172 WeakPolarHBondContact O-CB 3.45Å; T168-A172 PolarHBondContact O-N 3.04Å; T168-I203 HydrophobicContact CG2-CD1 3.89Å; T168-I203 HydrophobicContact CG2-CG1 4.22Å
169	F	97.8	Very high	98.2	Very high	158 Å²	158	56.6 Å²	56.6	69%	0.693	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-46.3	173.7	-179.6	-92.7	0	0	0	112	S167 A172 E173	S167-F169 PolarHBondContact O-N 3.02Å; F169-A172 PolarHBondContact O-N 3.17Å; F169-E173 PolarHBondContact O-N 2.99Å
170	K	98.3	Very high	98.2	Very high	82 Å²	82	51 Å²	51	36%	0.357	26%	0.258	S	S	.	.	H	α-helix	trans	-70.9	-33.8	179.5	-170	52.1	165.7	-178	0	112.2	L55 S167 E173 L174	L55-K170 HydrophobicContact CD2-CB 4.26Å; L55-K170 HydrophobicContact CD2-CG 3.9Å; S167-K170 PolarHBondContact O-N 3.3Å; K170-E173 WeakPolarHBondContact CD-OE2 3.27Å; K170-E173 IonicContact NZ-OE1 3.43Å; K170-E173 PolarHBondContact NZ-OE1 2.99Å; K170-E173 IonicContact NZ-OE2 2.7Å; K170-E173 PolarHBondContact NZ-OE2 2.85Å; K170-L174 HydrophobicContact CD-CD1 4.34Å; K170-L174 HydrophobicContact CD-CG 4.36Å; K170-L174 HydrophobicContact CG-CD1 4.21Å; K170-L174 WeakPolarHBondContact O-CD1 3.29Å; K170-L174 WeakPolarHBondContact O-CG 3.34Å; K170-L174 PolarHBondContact O-N 2.65Å
171	F	98.8	Very high	98.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-48.1	170.7	172.2	-96.5	0	0	0	111.5	L55 I59 V112 F114 F132 F134 I166 S167 T168 L174 L175 M200 I203	L55-F171 HydrophobicContact CD1-CD2 4.25Å; I59-F171 HydrophobicContact CD1-CD2 4.37Å; V112-F171 HydrophobicContact CG1-CE2 4.14Å; V112-F171 HydrophobicContact CG1-CZ 3.72Å; F114-F171 HydrophobicContact CE2-CE2 4.16Å; F114-F171 AromaticContact CE2-CZ 3.77Å; F114-F171 HydrophobicContact CE2-CZ 3.77Å; F114-F171 AromaticContact CZ-CZ 3.86Å; F114-F171 HydrophobicContact CZ-CZ 3.86Å; F132-F171 HydrophobicContact CB-CE2 4.34Å; F132-F171 AromaticContact CD1-CD2 3.72Å; F132-F171 HydrophobicContact CD1-CD2 3.72Å; F132-F171 AromaticContact CD1-CE2 3.57Å; F132-F171 HydrophobicContact CD1-CE2 3.57Å; F132-F171 HydrophobicContact CD2-CE2 4.06Å; F132-F171 AromaticContact CE1-CD2 3.98Å; F132-F171 HydrophobicContact CE1-CD2 3.98Å; F132-F171 AromaticContact CE1-CE2 3.74Å; F132-F171 HydrophobicContact CE1-CE2 3.74Å; F132-F171 HydrophobicContact CE2-CE2 4.23Å; F132-F171 HydrophobicContact CG-CD2 4.24Å; F132-F171 AromaticContact CG-CE2 3.73Å; F132-F171 HydrophobicContact CG-CE2 3.73Å; F132-F171 HydrophobicContact CZ-CE2 4.06Å; F134-F171 HydrophobicContact CE1-CB 3.85Å; F134-F171 AromaticContact CE1-CD1 3.98Å; F134-F171 HydrophobicContact CE1-CD1 3.98Å; F134-F171 HydrophobicContact CE1-CD2 4.04Å; F134-F171 AromaticContact CE1-CG 3.71Å; F134-F171 HydrophobicContact CE1-CG 3.71Å; F134-F171 AromaticContact CZ-CD1 3.95Å; F134-F171 HydrophobicContact CZ-CD1 3.95Å; F134-F171 HydrophobicContact CZ-CD2 4.04Å; F134-F171 HydrophobicContact CZ-CE1 4.01Å; F134-F171 HydrophobicContact CZ-CE2 4.11Å; F134-F171 AromaticContact CZ-CG 3.95Å; F134-F171 HydrophobicContact CZ-CG 3.95Å; F134-F171 HydrophobicContact CZ-CZ 4.08Å; I166-F171 HydrophobicContact CG2-CB 3.81Å; S167-F171 PolarHBondContact O-N 2.7Å; T168-F171 PolarHBondContact O-N 2.63Å; F171-L174 PolarHBondContact O-N 3.25Å; F171-L175 HydrophobicContact CE1-CD2 3.71Å; F171-L175 HydrophobicContact CE2-CD2 4.44Å; F171-L175 HydrophobicContact CZ-CD2 3.66Å; F171-L175 VanDerWaalsContact O-CB 3.29Å; F171-L175 WeakPolarHBondContact O-CB 3.27Å; F171-L175 PolarHBondContact O-N 2.93Å; F171-M200 HydrophobicContact CE1-CE 4.08Å; F171-M200 HydrophobicContact CE1-SD 4.32Å; F171-M200 HydrophobicContact CZ-CE 4.37Å; F171-I203 HydrophobicContact CD1-CG2 3.93Å; F171-I203 HydrophobicContact CE1-CG2 4.37Å
172	A	98.7	Very high	98.2	Very high	7 Å²	7	51.1 Å²	51.1	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-49.7	177.6	0	0	0	0	0	112.3	T168 F169 L174 L175 L176 I203	T168-A172 WeakPolarHBondContact O-CB 3.45Å; T168-A172 PolarHBondContact O-N 3.04Å; F169-A172 PolarHBondContact O-N 3.17Å; A172-L174 PolarHBondContact O-N 3.46Å; A172-L175 PolarHBondContact O-N 2.91Å; A172-L176 WeakPolarHBondContact O-CB 3.24Å; A172-L176 WeakPolarHBondContact O-CD1 3.35Å; A172-L176 WeakPolarHBondContact O-CG 3.32Å; A172-L176 PolarHBondContact O-N 2.99Å; A172-I203 HydrophobicContact CB-CG2 3.91Å; A172-I203 VanDerWaalsContact CB-O 3.32Å; A172-I203 WeakPolarHBondContact CB-O 3.42Å
173	E	98.1	Very high	98.2	Very high	85 Å²	85	50.2 Å²	50.2	40%	0.397	26%	0.261	S	S	.	.	H	α-helix	trans	-50.4	-44.2	177.4	-172.1	-150.2	119.8	0	0	112.2	F169 K170 T177	F169-E173 PolarHBondContact O-N 2.99Å; K170-E173 WeakPolarHBondContact CD-OE2 3.27Å; K170-E173 IonicContact NZ-OE1 3.43Å; K170-E173 PolarHBondContact NZ-OE1 2.99Å; K170-E173 IonicContact NZ-OE2 2.7Å; K170-E173 PolarHBondContact NZ-OE2 2.85Å; E173-T177 PolarHBondContact O-OG1 3.24Å
174	L	98.5	Very high	98.1	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-77.3	-45.7	-179.3	-64.8	174.7	0	0	0	111.9	L55 R56 I59 K170 F171 A172 L176 T177 S178	L55-L174 HydrophobicContact CD2-CD1 3.87Å; L55-L174 HydrophobicContact CG-CD1 3.75Å; R56-L174 HydrophobicContact CB-CD1 4.46Å; R56-L174 VanDerWaalsContact CD-CD2 3.43Å; I59-L174 HydrophobicContact CD1-CB 3.56Å; I59-L174 HydrophobicContact CD1-CD1 4.12Å; I59-L174 HydrophobicContact CG2-CB 4.14Å; K170-L174 HydrophobicContact CD-CD1 4.34Å; K170-L174 HydrophobicContact CD-CG 4.36Å; K170-L174 HydrophobicContact CG-CD1 4.21Å; K170-L174 WeakPolarHBondContact O-CD1 3.29Å; K170-L174 WeakPolarHBondContact O-CG 3.34Å; K170-L174 PolarHBondContact O-N 2.65Å; F171-L174 PolarHBondContact O-N 3.25Å; A172-L174 PolarHBondContact O-N 3.46Å; L174-L176 VanDerWaalsContact C-N 3.34Å; L174-L176 PolarHBondContact O-N 2.76Å; L174-T177 PolarHBondContact O-N 3.2Å; L174-T177 VanDerWaalsContact O-N 3.12Å; L174-T177 PolarHBondContact O-OG1 3.37Å; L174-T177 VanDerWaalsContact O-OG1 3.12Å; L174-S178 PolarHBondContact O-N 3.24Å
175	L	98.4	Very high	97.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-37.7	-177.2	-167.8	65.2	0	0	0	111.9	F114 F171 A172 T177 S178 L180 V181 M200 L204	F114-L175 HydrophobicContact CE2-CD1 4.14Å; F114-L175 HydrophobicContact CE2-CD2 4.05Å; F114-L175 HydrophobicContact CZ-CD2 4.1Å; F171-L175 HydrophobicContact CE1-CD2 3.71Å; F171-L175 HydrophobicContact CE2-CD2 4.44Å; F171-L175 HydrophobicContact CZ-CD2 3.66Å; F171-L175 VanDerWaalsContact O-CB 3.29Å; F171-L175 WeakPolarHBondContact O-CB 3.27Å; F171-L175 PolarHBondContact O-N 2.93Å; A172-L175 PolarHBondContact O-N 2.91Å; L175-T177 PolarHBondContact O-N 2.76Å; L175-T177 VanDerWaalsContact O-N 3.15Å; L175-S178 WeakPolarHBondContact O-CB 3.45Å; L175-S178 PolarHBondContact O-N 3.04Å; L175-S178 PolarHBondContact O-OG 3.13Å; L175-L180 HydrophobicContact CD1-CB 4.12Å; L175-L180 HydrophobicContact CD1-CD2 3.76Å; L175-V181 HydrophobicContact CD2-CG1 4.37Å; L175-V181 HydrophobicContact CG-CG1 4.37Å; L175-M200 HydrophobicContact CD2-CE 3.65Å; L175-L204 HydrophobicContact CB-CD2 4.39Å; L175-L204 HydrophobicContact CD2-CD2 4.12Å; L175-L204 HydrophobicContact CG-CD2 4.43Å
176	L	98.2	Very high	97.9	Very high	66 Å²	66	50.4 Å²	50.4	35%	0.346	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.5	175.1	-72.1	168.2	0	0	0	114	A172 L174 V181 L182 L204 Y223	A172-L176 WeakPolarHBondContact O-CB 3.24Å; A172-L176 WeakPolarHBondContact O-CD1 3.35Å; A172-L176 WeakPolarHBondContact O-CG 3.32Å; A172-L176 PolarHBondContact O-N 2.99Å; L174-L176 VanDerWaalsContact C-N 3.34Å; L174-L176 PolarHBondContact O-N 2.76Å; L176-V181 HydrophobicContact CD2-CG2 4.42Å; L176-L182 HydrophobicContact CD2-CD1 4.19Å; L176-L204 HydrophobicContact CD2-CD2 3.82Å; L176-L204 HydrophobicContact CG-CD2 3.93Å; L176-Y223 HydrophobicContact CD2-CD1 4.37Å; L176-Y223 HydrophobicContact CD2-CE1 3.74Å
177	T	96.6	Very high	97.9	Very high	107 Å²	107	51.3 Å²	51.3	66%	0.656	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	5.4	-179.4	58.3	0	0	0	0	113.8	E173 L174 L175	E173-T177 PolarHBondContact O-OG1 3.24Å; L174-T177 PolarHBondContact O-N 3.2Å; L174-T177 VanDerWaalsContact O-N 3.12Å; L174-T177 PolarHBondContact O-OG1 3.37Å; L174-T177 VanDerWaalsContact O-OG1 3.12Å; L175-T177 PolarHBondContact O-N 2.76Å; L175-T177 VanDerWaalsContact O-N 3.15Å
178	S	97.6	Very high	97.9	Very high	8 Å²	8	48.3 Å²	48.3	6%	0.056	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-15.8	-172.8	69.7	0	0	0	0	115.5	S63 L174 L175 L180	S63-S178 WeakPolarHBondContact CB-O 3.49Å; S63-S178 WeakPolarHBondContact OG-CA 3.17Å; S63-S178 WeakPolarHBondContact OG-CB 3.45Å; S63-S178 PolarHBondContact OG-O 3.28Å; L174-S178 PolarHBondContact O-N 3.24Å; L175-S178 WeakPolarHBondContact O-CB 3.45Å; L175-S178 PolarHBondContact O-N 3.04Å; L175-S178 PolarHBondContact O-OG 3.13Å; S178-L180 VanDerWaalsContact C-N 3.34Å; S178-L180 WeakPolarHBondContact OG-CD1 3.49Å; S178-L180 PolarHBondContact OG-N 2.78Å
179	G	97.5	Very high	98	Very high	28 Å²	28	45.5 Å²	45.5	29%	0.289	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	12.5	-172.3	0	0	0	0	0	115	M183	G179-M183 WeakPolarHBondContact O-CG 3.44Å
180	L	98.2	Very high	98	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-87.6	-33.8	174.7	-81	61.8	0	0	0	112.7	M62 V66 I72 F116 L175 S178 W188	M62-L180 HydrophobicContact CB-CD2 4.35Å; M62-L180 HydrophobicContact CE-CD2 3.72Å; V66-L180 HydrophobicContact CB-CD1 3.94Å; V66-L180 HydrophobicContact CB-CG 4.38Å; V66-L180 HydrophobicContact CG1-CD1 3.79Å; V66-L180 HydrophobicContact CG2-CD1 4.37Å; V66-L180 HydrophobicContact CG2-CG 4.35Å; I72-L180 HydrophobicContact CD1-CB 4.07Å; I72-L180 HydrophobicContact CD1-CD2 4.21Å; I72-L180 HydrophobicContact CD1-CG 3.81Å; F116-L180 HydrophobicContact CE1-CD2 4.27Å; F116-L180 HydrophobicContact CE1-CG 4.35Å; F116-L180 HydrophobicContact CZ-CD2 3.74Å; F116-L180 HydrophobicContact CZ-CG 4.32Å; L175-L180 HydrophobicContact CD1-CB 4.12Å; L175-L180 HydrophobicContact CD1-CD2 3.76Å; S178-L180 VanDerWaalsContact C-N 3.34Å; S178-L180 WeakPolarHBondContact OG-CD1 3.49Å; S178-L180 PolarHBondContact OG-N 2.78Å; L180-W188 HydrophobicContact CB-CZ2 4.39Å; L180-W188 WeakPolarHBondContact O-CZ2 3.39Å; L180-W188 PolarHBondContact O-NE1 3.45Å
181	V	98.4	Very high	98	Very high	4 Å²	4	35 Å²	35	2%	0.024	19%	0.194	C	C	.	.	S	Bend	trans	-114.7	160.3	-179.9	-61.7	0	0	0	0	110.1	L175 L176 M183 W188 L204 F224	L175-V181 HydrophobicContact CD2-CG1 4.37Å; L175-V181 HydrophobicContact CG-CG1 4.37Å; L176-V181 HydrophobicContact CD2-CG2 4.42Å; V181-M183 PolarHBondContact O-N 2.65Å; V181-W188 HydrophobicContact CG1-CH2 4.45Å; V181-W188 HydrophobicContact CG1-CZ2 3.87Å; V181-L204 HydrophobicContact CG1-CD1 4.02Å; V181-L204 HydrophobicContact CG2-CD2 4.33Å; V181-F224 HydrophobicContact CG1-CD1 4.46Å; V181-F224 HydrophobicContact CG1-CE1 3.76Å; V181-F224 HydrophobicContact CG1-CZ 4.13Å
182	L	98.1	Very high	97.9	Very high	86 Å²	86	38.9 Å²	38.9	45%	0.45	21%	0.211	S	C	.	.	S	Bend	trans	64.8	21	-175.9	-51.4	158.3	0	0	0	113.6	L176 Y223	L176-L182 HydrophobicContact CD2-CD1 4.19Å; L182-Y223 HydrophobicContact CD2-CD1 3.71Å; L182-Y223 HydrophobicContact CD2-CE1 4.03Å; L182-Y223 HydrophobicContact CD2-CG 4.22Å; L182-Y223 HydrophobicContact CG-CD1 4.05Å; L182-Y223 HydrophobicContact CG-CE1 4.48Å; L182-Y223 PolarHBondContact N-O 3.03Å
183	M	97.8	Very high	97.9	Very high	77 Å²	77	38.5 Å²	38.5	38%	0.379	21%	0.208	S	C	.	.			trans	-122.7	115.4	-173.5	-64	-59.5	-65.7	0	0	111.8	G179 V181 N185 V186	G179-M183 WeakPolarHBondContact O-CG 3.44Å; V181-M183 PolarHBondContact O-N 2.65Å; M183-N185 WeakPolarHBondContact CE-OD1 3.42Å; M183-N185 PolarHBondContact O-N 3.15Å; M183-N185 VanDerWaalsContact O-N 3.16Å; M183-V186 HydrophobicContact CB-CB 4.42Å; M183-V186 HydrophobicContact CB-CG2 3.8Å; M183-V186 PolarHBondContact O-N 3.33Å; M183-V186 VanDerWaalsContact O-N 3.11Å
184	D	95.8	Very high	97.8	Very high	130 Å²	130	34.7 Å²	34.7	70%	0.695	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.7	-178.5	-63.8	-21.9	0	0	0	114	V186 P225	D184-V186 VanDerWaalsContact C-N 3.34Å; D184-P225 WeakPolarHBondContact OD1-CB 3.32Å; D184-P225 WeakPolarHBondContact OD1-CG 3.41Å
185	N	96.2	Very high	97.8	Very high	93 Å²	93	36.5 Å²	36.5	50%	0.497	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.1	179	69	-82.9	0	0	0	113.9	M183	M183-N185 WeakPolarHBondContact CE-OD1 3.42Å; M183-N185 PolarHBondContact O-N 3.15Å; M183-N185 VanDerWaalsContact O-N 3.16Å
186	V	98.2	Very high	97.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-102.2	123.2	178.4	-177.5	0	0	0	0	109.6	V66 P70 I72 M183 D184	V66-V186 HydrophobicContact CG2-CG1 4.4Å; V66-V186 HydrophobicContact CG2-CG2 3.83Å; P70-V186 WeakPolarHBondContact O-CA 3.29Å; I72-V186 HydrophobicContact CD1-CG1 3.58Å; I72-V186 HydrophobicContact CG1-CG1 3.87Å; M183-V186 HydrophobicContact CB-CB 4.42Å; M183-V186 HydrophobicContact CB-CG2 3.8Å; M183-V186 PolarHBondContact O-N 3.33Å; M183-V186 VanDerWaalsContact O-N 3.11Å; D184-V186 VanDerWaalsContact C-N 3.34Å
187	L	98.4	Very high	97.9	Very high	21 Å²	21	33.8 Å²	33.8	11%	0.11	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.2	176.2	168.8	62.2	0	0	0	110	P70 V71 I72 L189 V226 Y228	P70-L187 PolarHBondContact O-N 3.43Å; V71-L187 CarbonylContact C-O 3.53Å; V71-L187 WeakPolarHBondContact CA-O 3.49Å; V71-L187 HydrophobicContact CG1-CB 4.39Å; V71-L187 HydrophobicContact CG1-CD2 4.01Å; V71-L187 HydrophobicContact CG1-CG 4.12Å; V71-L187 HydrophobicContact CG2-CB 4.25Å; V71-L187 HydrophobicContact CG2-CD2 4.16Å; I72-L187 PolarHBondContact N-O 2.99Å; L187-L189 HydrophobicContact CD1-CD2 4.29Å; L187-L189 HydrophobicContact CD2-CD2 4.01Å; L187-L189 HydrophobicContact CG-CD2 3.96Å; L187-V226 HydrophobicContact CD1-CB 4.19Å; L187-V226 HydrophobicContact CD1-CG1 3.59Å; L187-Y228 HydrophobicContact CD1-CD2 3.6Å; L187-Y228 HydrophobicContact CD1-CE2 3.85Å; L187-Y228 HydrophobicContact CD1-CG 4.45Å; L187-Y228 HydrophobicContact CD2-CD2 4.23Å; L187-Y228 HydrophobicContact CD2-CE2 4.27Å; L187-Y228 HydrophobicContact CG-CD2 4.48Å
188	W	98.8	Very high	97.9	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.8	175.4	-71	78	0	0	0	111.3	I72 M74 F114 L180 V181 F197 F224 V226 V227 Y228	I72-W188 HydrophobicContact CB-CD2 4.28Å; I72-W188 HydrophobicContact CB-CE3 4.19Å; I72-W188 HydrophobicContact CB-CZ3 4.3Å; I72-W188 HydrophobicContact CD1-CH2 4.16Å; I72-W188 HydrophobicContact CD1-CZ2 3.81Å; I72-W188 HydrophobicContact CG2-CE3 4.06Å; I72-W188 HydrophobicContact CG2-CH2 4.03Å; I72-W188 HydrophobicContact CG2-CZ3 3.75Å; I72-W188 CarbonylContact O-C 3.04Å; I72-W188 WeakPolarHBondContact O-CA 3.24Å; M74-W188 HydrophobicContact CB-CE3 3.9Å; M74-W188 HydrophobicContact CB-CZ3 3.92Å; M74-W188 HydrophobicContact CG-CE3 4.28Å; M74-W188 HydrophobicContact CG-CZ3 3.93Å; F114-W188 HydrophobicContact CD1-CH2 4.2Å; F114-W188 AromaticContact CD1-CZ3 3.84Å; F114-W188 HydrophobicContact CD1-CZ3 3.84Å; F114-W188 AromaticContact CE1-CH2 3.92Å; F114-W188 HydrophobicContact CE1-CH2 3.92Å; F114-W188 AromaticContact CE1-CZ3 3.66Å; F114-W188 HydrophobicContact CE1-CZ3 3.66Å; F114-W188 HydrophobicContact CZ-CH2 4.19Å; F114-W188 HydrophobicContact CZ-CZ3 4.37Å; L180-W188 HydrophobicContact CB-CZ2 4.39Å; L180-W188 WeakPolarHBondContact O-CZ2 3.39Å; L180-W188 PolarHBondContact O-NE1 3.45Å; V181-W188 HydrophobicContact CG1-CH2 4.45Å; V181-W188 HydrophobicContact CG1-CZ2 3.87Å; W188-F197 HydrophobicContact CB-CZ 4.31Å; W188-F224 AromaticContact CD1-CD1 3.84Å; W188-F224 AromaticContact CD2-CD1 3.57Å; W188-F224 HydrophobicContact CD2-CD1 3.57Å; W188-F224 AromaticContact CD2-CE1 3.88Å; W188-F224 HydrophobicContact CD2-CE1 3.88Å; W188-F224 AromaticContact CE2-CD1 3.48Å; W188-F224 VanDerWaalsContact CE2-CD1 3.48Å; W188-F224 AromaticContact CE2-CE1 3.68Å; W188-F224 HydrophobicContact CE3-CD1 4.14Å; W188-F224 HydrophobicContact CE3-CE1 4.06Å; W188-F224 AromaticContact CG-CD1 3.81Å; W188-F224 HydrophobicContact CG-CD1 3.81Å; W188-F224 HydrophobicContact CH2-CD1 4.49Å; W188-F224 AromaticContact CH2-CE1 3.87Å; W188-F224 HydrophobicContact CH2-CE1 3.87Å; W188-F224 AromaticContact CZ2-CD1 3.97Å; W188-F224 HydrophobicContact CZ2-CD1 3.97Å; W188-F224 AromaticContact CZ2-CE1 3.67Å; W188-F224 HydrophobicContact CZ2-CE1 3.67Å; W188-F224 HydrophobicContact CZ3-CE1 4.06Å; W188-F224 AromaticContact NE1-CD1 3.64Å; W188-V226 PolarHBondContact N-O 3.15Å; W188-V227 HydrophobicContact CB-CG2 4.17Å; W188-V227 CarbonylContact O-C 3.56Å; W188-V227 WeakPolarHBondContact O-CA 3.43Å; W188-Y228 PolarHBondContact O-N 3.32Å
189	L	98.8	Very high	98	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.8	173.6	-48.9	177.2	0	0	0	108.8	V71 I72 A73 M74 L187 Y228 F273 F274	V71-L189 HydrophobicContact CG1-CD1 3.43Å; V71-L189 VanDerWaalsContact CG1-CD1 3.43Å; V71-L189 HydrophobicContact CG1-CD2 4.18Å; V71-L189 HydrophobicContact CG1-CG 3.63Å; I72-L189 PolarHBondContact O-N 3.25Å; A73-L189 CarbonylContact C-O 3.53Å; A73-L189 WeakPolarHBondContact CA-O 3.13Å; A73-L189 HydrophobicContact CB-CB 4Å; A73-L189 HydrophobicContact CB-CD1 4.43Å; M74-L189 PolarHBondContact N-O 3.49Å; L187-L189 HydrophobicContact CD1-CD2 4.29Å; L187-L189 HydrophobicContact CD2-CD2 4.01Å; L187-L189 HydrophobicContact CG-CD2 3.96Å; L189-Y228 WeakPolarHBondContact CA-O 3.4Å; L189-Y228 HydrophobicContact CD2-CD2 4.2Å; L189-F273 HydrophobicContact CD1-CB 3.92Å; L189-F273 HydrophobicContact CD1-CD1 3.35Å; L189-F273 HydrophobicContact CD1-CD2 4.48Å; L189-F273 HydrophobicContact CD1-CE1 3.95Å; L189-F273 HydrophobicContact CD1-CG 3.67Å; L189-F273 HydrophobicContact CD2-CD1 3.73Å; L189-F273 HydrophobicContact CD2-CD2 3.76Å; L189-F273 HydrophobicContact CD2-CE1 3.66Å; L189-F273 HydrophobicContact CD2-CE2 3.67Å; L189-F273 HydrophobicContact CD2-CG 3.78Å; L189-F273 HydrophobicContact CD2-CZ 3.62Å; L189-F273 HydrophobicContact CG-CD1 4.17Å; L189-F273 HydrophobicContact CG-CE1 4.46Å; L189-F273 HydrophobicContact CG-CG 4.24Å; L189-F274 HydrophobicContact CD1-CE2 4.01Å; L189-F274 HydrophobicContact CD1-CZ 4.44Å
190	S	98.7	Very high	98	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	172.7	-173.9	62.2	0	0	0	0	111	S193 Y228 V230	S190-S193 VanDerWaalsContact CB-OG 3.28Å; S190-S193 WeakPolarHBondContact CB-OG 3.48Å; S190-S193 WeakPolarHBondContact OG-CB 3.48Å; S190-S193 PolarHBondContact OG-OG 3.22Å; S190-Y228 PolarHBondContact N-O 2.81Å; S190-Y228 PolarHBondContact OG-O 2.89Å; S190-V230 WeakPolarHBondContact O-CB 3.5Å; S190-V230 WeakPolarHBondContact O-CG2 3.43Å; S190-V230 PolarHBondContact O-N 3.41Å
191	F	98.4	Very high	98.1	Very high	20 Å²	20	27.1 Å²	27.1	9%	0.088	14%	0.137	C	C	.	.	S	Bend	trans	-138	116	178.4	-177.4	-91	0	0	0	111.8	S193 V230 K231 M234 L244 I247 T269	F191-S193 VanDerWaalsContact C-N 3.31Å; F191-S193 PolarHBondContact O-N 3.3Å; F191-V230 HydrophobicContact CD2-CB 3.91Å; F191-V230 HydrophobicContact CD2-CG1 3.84Å; F191-V230 HydrophobicContact CE2-CG1 4.31Å; F191-K231 HydrophobicContact CD2-CB 4.04Å; F191-K231 HydrophobicContact CE1-CD 3.95Å; F191-K231 HydrophobicContact CE2-CB 3.9Å; F191-K231 HydrophobicContact CE2-CD 3.67Å; F191-K231 HydrophobicContact CE2-CG 4.4Å; F191-K231 HydrophobicContact CG-CB 4.46Å; F191-K231 HydrophobicContact CZ-CB 4.25Å; F191-K231 HydrophobicContact CZ-CD 3.32Å; F191-K231 HydrophobicContact CZ-CG 4.34Å; F191-M234 HydrophobicContact CE2-SD 3.91Å; F191-L244 HydrophobicContact CB-CD1 4.4Å; F191-L244 HydrophobicContact CD1-CB 3.85Å; F191-L244 HydrophobicContact CD2-CB 4.45Å; F191-L244 HydrophobicContact CD2-CD1 4.04Å; F191-L244 HydrophobicContact CE1-CB 3.84Å; F191-L244 HydrophobicContact CE2-CB 4.47Å; F191-L244 HydrophobicContact CG-CB 4.16Å; F191-L244 HydrophobicContact CG-CD1 4.11Å; F191-L244 HydrophobicContact CZ-CB 4.15Å; F191-L244 VanDerWaalsContact CZ-N 3.32Å; F191-I247 HydrophobicContact CD2-CD1 4.47Å; F191-I247 HydrophobicContact CE2-CD1 3.3Å; F191-I247 HydrophobicContact CZ-CD1 3.52Å; F191-T269 HydrophobicContact CB-CG2 4.18Å
192	H	96.9	Very high	98.1	Very high	80 Å²	80	29 Å²	29	37%	0.37	15%	0.145	S	C	.	.	S	Bend	trans	58.6	41.3	179.1	-165.1	-174.6	0	0	0	113.1	G194 D229 K231 Y295	H192-G194 PolarHBondContact O-N 3.21Å; H192-D229 WeakPolarHBondContact CA-OD2 3.43Å; H192-D229 PolarHBondContact N-OD1 3.48Å; H192-D229 PolarHBondContact N-OD2 3.33Å; H192-K231 HydrophobicContact CB-CB 4.03Å; H192-K231 HydrophobicContact CB-CG 4.08Å; H192-Y295 AromaticContact CD2-CD1 3.37Å; H192-Y295 WeakPolarHBondContact CD2-CD1 3.2Å; H192-Y295 AromaticContact NE2-CD1 3.51Å; H192-Y295 AromaticContact NE2-CE1 3.85Å
193	S	97.9	Very high	98.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	24.5	-146.6	53	0	0	0	0	116.4	S190 F191 Y195 D196 F197 D229	S190-S193 VanDerWaalsContact CB-OG 3.28Å; S190-S193 WeakPolarHBondContact CB-OG 3.48Å; S190-S193 WeakPolarHBondContact OG-CB 3.48Å; S190-S193 PolarHBondContact OG-OG 3.22Å; F191-S193 VanDerWaalsContact C-N 3.31Å; F191-S193 PolarHBondContact O-N 3.3Å; S193-Y195 PolarHBondContact O-N 3.19Å; S193-D196 WeakPolarHBondContact CA-OD2 3.32Å; S193-D196 WeakPolarHBondContact CB-OD2 3.3Å; S193-D196 PolarHBondContact O-N 3Å; S193-F197 WeakPolarHBondContact O-CD2 3.21Å; S193-F197 PolarHBondContact O-N 2.67Å; S193-D229 PolarHBondContact N-OD2 3.12Å
194	G	97.4	Very high	98.1	Very high	4 Å²	4	22.5 Å²	22.5	4%	0.041	11%	0.112	C	C	.	.	H	α-helix	trans	-54.1	-54.2	175.5	0	0	0	0	0	111.7	H192 G198	H192-G194 PolarHBondContact O-N 3.21Å; G194-G198 PolarHBondContact O-N 2.91Å
195	Y	98.2	Very high	98.2	Very high	40 Å²	40	17.9 Å²	17.9	16%	0.157	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-42.5	179	-80.1	-100.5	0	0	0	112.5	F78 I81 L99 M100 N103 V104 S193 F197 G198 Y199	F78-Y195 HydrophobicContact CE1-CG 4.37Å; F78-Y195 AromaticContact CE2-CD1 3.74Å; F78-Y195 HydrophobicContact CE2-CD1 3.74Å; F78-Y195 HydrophobicContact CE2-CE1 4.29Å; F78-Y195 HydrophobicContact CE2-CG 4.27Å; F78-Y195 AromaticContact CZ-CD1 3.66Å; F78-Y195 HydrophobicContact CZ-CD1 3.66Å; F78-Y195 HydrophobicContact CZ-CE1 4.49Å; F78-Y195 AromaticContact CZ-CG 3.71Å; F78-Y195 HydrophobicContact CZ-CG 3.71Å; I81-Y195 WeakPolarHBondContact CD1-OH 2.94Å; I81-Y195 HydrophobicContact CG1-CE1 4.25Å; L99-Y195 PolarHBondContact O-OH 2.74Å; M100-Y195 HydrophobicContact CB-CD2 4.35Å; M100-Y195 HydrophobicContact CB-CE1 4.31Å; M100-Y195 HydrophobicContact CB-CE2 3.94Å; M100-Y195 HydrophobicContact CG-CD1 4.09Å; M100-Y195 HydrophobicContact CG-CD2 4Å; M100-Y195 HydrophobicContact CG-CE1 4.2Å; M100-Y195 HydrophobicContact CG-CE2 4.09Å; M100-Y195 HydrophobicContact CG-CG 4Å; N103-Y195 HydrophobicContact CB-CE1 4.14Å; V104-Y195 HydrophobicContact CG2-CD1 3.89Å; V104-Y195 HydrophobicContact CG2-CE1 4.43Å; S193-Y195 PolarHBondContact O-N 3.19Å; Y195-F197 PolarHBondContact O-N 3.15Å; Y195-G198 CarbonylContact O-C 3.53Å; Y195-G198 WeakPolarHBondContact O-CA 3.33Å; Y195-G198 PolarHBondContact O-N 3.46Å; Y195-G198 VanDerWaalsContact O-N 3.08Å; Y195-Y199 HydrophobicContact CD1-CE2 4.5Å; Y195-Y199 VanDerWaalsContact O-CD2 3.23Å; Y195-Y199 WeakPolarHBondContact O-CD2 3.39Å; Y195-Y199 PolarHBondContact O-N 3.22Å
196	D	98.7	Very high	98.2	Very high	9 Å²	9	16.6 Å²	16.6	5%	0.048	10%	0.099	C	C	.	.	H	α-helix	trans	-57	-52.7	179.8	-50.8	-40.1	0	0	0	111.4	M74 T76 S193 G198 Y199 M200	M74-D196 HydrophobicContact CE-CB 3.65Å; M74-D196 HydrophobicContact SD-CB 3.7Å; T76-D196 WeakPolarHBondContact CB-OD1 3.28Å; T76-D196 HydrophobicContact CG2-CB 3.9Å; T76-D196 PolarHBondContact N-OD1 2.93Å; T76-D196 PolarHBondContact OG1-OD1 3.21Å; S193-D196 WeakPolarHBondContact CA-OD2 3.32Å; S193-D196 WeakPolarHBondContact CB-OD2 3.3Å; S193-D196 PolarHBondContact O-N 3Å; D196-G198 VanDerWaalsContact C-N 3.3Å; D196-G198 PolarHBondContact O-N 2.88Å; D196-Y199 PolarHBondContact O-N 2.87Å; D196-M200 WeakPolarHBondContact O-CG 3.39Å; D196-M200 PolarHBondContact O-N 3.4Å
197	F	98.5	Very high	98	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.6	-30.2	176.1	-75.1	-64.2	0	0	0	112.1	M74 W188 S193 Y195 M200 I201 F216 L220 F224 V227 L294	M74-F197 HydrophobicContact CE-CD1 3.81Å; M74-F197 HydrophobicContact CE-CD2 4.19Å; M74-F197 HydrophobicContact CE-CE1 3.58Å; M74-F197 HydrophobicContact CE-CE2 3.99Å; M74-F197 HydrophobicContact CE-CG 4.1Å; M74-F197 HydrophobicContact CE-CZ 3.68Å; W188-F197 HydrophobicContact CB-CZ 4.31Å; S193-F197 WeakPolarHBondContact O-CD2 3.21Å; S193-F197 PolarHBondContact O-N 2.67Å; Y195-F197 PolarHBondContact O-N 3.15Å; F197-M200 PolarHBondContact O-N 3.38Å; F197-I201 WeakPolarHBondContact O-CB 3.36Å; F197-I201 WeakPolarHBondContact O-CG1 3.33Å; F197-I201 PolarHBondContact O-N 2.84Å; F197-F216 HydrophobicContact CB-CZ 4.15Å; F197-L220 HydrophobicContact CB-CD1 3.64Å; F197-L220 HydrophobicContact CD1-CD1 3.58Å; F197-L220 HydrophobicContact CD2-CD1 4.27Å; F197-L220 HydrophobicContact CE1-CD1 4.29Å; F197-L220 HydrophobicContact CG-CD1 3.57Å; F197-F224 HydrophobicContact CD1-CD1 4.4Å; F197-F224 AromaticContact CD1-CD2 3.84Å; F197-F224 HydrophobicContact CD1-CD2 3.84Å; F197-F224 HydrophobicContact CD1-CE1 4.48Å; F197-F224 AromaticContact CD1-CE2 3.93Å; F197-F224 HydrophobicContact CD1-CE2 3.93Å; F197-F224 HydrophobicContact CD1-CG 4.08Å; F197-F224 HydrophobicContact CD1-CZ 4.26Å; F197-F224 HydrophobicContact CE1-CB 4.23Å; F197-F224 AromaticContact CE1-CD1 3.78Å; F197-F224 HydrophobicContact CE1-CD1 3.78Å; F197-F224 AromaticContact CE1-CD2 3.98Å; F197-F224 HydrophobicContact CE1-CD2 3.98Å; F197-F224 HydrophobicContact CE1-CE1 4.08Å; F197-F224 HydrophobicContact CE1-CE2 4.27Å; F197-F224 AromaticContact CE1-CG 3.72Å; F197-F224 HydrophobicContact CE1-CG 3.72Å; F197-F224 HydrophobicContact CE1-CZ 4.31Å; F197-V227 HydrophobicContact CE1-CG2 4.34Å; F197-V227 HydrophobicContact CE2-CG1 3.53Å; F197-V227 HydrophobicContact CE2-CG2 4.46Å; F197-V227 HydrophobicContact CZ-CB 4.46Å; F197-V227 HydrophobicContact CZ-CG1 3.62Å; F197-V227 HydrophobicContact CZ-CG2 3.92Å; F197-L294 HydrophobicContact CB-CD1 4.19Å; F197-L294 HydrophobicContact CD2-CD1 3.85Å; F197-L294 HydrophobicContact CD2-CD2 3.74Å; F197-L294 HydrophobicContact CD2-CG 4.48Å; F197-L294 HydrophobicContact CE2-CD2 3.87Å; F197-L294 HydrophobicContact CG-CD1 4.39Å
198	G	98.4	Very high	97.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-54.6	-53.4	167.9	0	0	0	0	0	112.1	G194 Y195 D196 I201 K202 L209	G194-G198 PolarHBondContact O-N 2.91Å; Y195-G198 CarbonylContact O-C 3.53Å; Y195-G198 WeakPolarHBondContact O-CA 3.33Å; Y195-G198 PolarHBondContact O-N 3.46Å; Y195-G198 VanDerWaalsContact O-N 3.08Å; D196-G198 VanDerWaalsContact C-N 3.3Å; D196-G198 PolarHBondContact O-N 2.88Å; G198-I201 PolarHBondContact O-N 3.29Å; G198-K202 WeakPolarHBondContact O-CB 3.3Å; G198-K202 PolarHBondContact O-N 3.11Å; G198-L209 WeakPolarHBondContact O-CD2 3.43Å
199	Y	98.7	Very high	97.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-44.5	176.8	-77.6	-71.7	0	0	0	112.1	F78 V104 L107 L109 Y195 D196 I201 K202 I203	F78-Y199 HydrophobicContact CB-CD2 4.31Å; F78-Y199 HydrophobicContact CB-CE2 3.52Å; F78-Y199 HydrophobicContact CD1-CD2 4.17Å; F78-Y199 AromaticContact CD1-CE2 3.65Å; F78-Y199 HydrophobicContact CD1-CE2 3.65Å; F78-Y199 AromaticContact CD2-CE2 3.66Å; F78-Y199 HydrophobicContact CD2-CE2 3.66Å; F78-Y199 AromaticContact CD2-CZ 3.97Å; F78-Y199 WeakPolarHBondContact CD2-OH 3.24Å; F78-Y199 HydrophobicContact CE1-CE2 4.22Å; F78-Y199 HydrophobicContact CE2-CE2 4.22Å; F78-Y199 HydrophobicContact CG-CD2 4.23Å; F78-Y199 AromaticContact CG-CE2 3.33Å; F78-Y199 HydrophobicContact CG-CE2 3.33Å; F78-Y199 AromaticContact CG-CZ 3.85Å; F78-Y199 HydrophobicContact CZ-CE2 4.48Å; V104-Y199 HydrophobicContact CG1-CD1 4.07Å; V104-Y199 HydrophobicContact CG1-CE1 4.29Å; V104-Y199 HydrophobicContact CG1-CG 4.31Å; V104-Y199 HydrophobicContact CG2-CD2 4.16Å; V104-Y199 HydrophobicContact CG2-CE1 4.49Å; V104-Y199 HydrophobicContact CG2-CE2 3.95Å; V104-Y199 HydrophobicContact CG2-CG 4.49Å; L107-Y199 WeakPolarHBondContact CB-OH 3.41Å; L109-Y199 HydrophobicContact CB-CD1 4.07Å; L109-Y199 HydrophobicContact CB-CG 4.46Å; L109-Y199 HydrophobicContact CD1-CD1 4.18Å; L109-Y199 HydrophobicContact CD1-CD2 4.02Å; L109-Y199 HydrophobicContact CD1-CG 3.77Å; Y195-Y199 HydrophobicContact CD1-CE2 4.5Å; Y195-Y199 VanDerWaalsContact O-CD2 3.23Å; Y195-Y199 WeakPolarHBondContact O-CD2 3.39Å; Y195-Y199 PolarHBondContact O-N 3.22Å; D196-Y199 PolarHBondContact O-N 2.87Å; Y199-I201 PolarHBondContact O-N 2.83Å; Y199-K202 PolarHBondContact O-N 3.04Å; Y199-I203 WeakPolarHBondContact O-CB 3.42Å; Y199-I203 VanDerWaalsContact O-CG1 3.26Å; Y199-I203 WeakPolarHBondContact O-CG1 3.44Å; Y199-I203 PolarHBondContact O-N 2.83Å
200	M	98.7	Very high	97.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-42.9	179.1	-72.1	-57.9	-58.8	0	0	112.4	M74 V112 F114 F171 L175 D196 F197 I203 L204 F224	M74-M200 HydrophobicContact CE-CG 4.4Å; V112-M200 HydrophobicContact CG2-SD 4.16Å; F114-M200 HydrophobicContact CE1-CE 4.38Å; F114-M200 HydrophobicContact CE1-SD 4.49Å; F114-M200 HydrophobicContact CZ-CE 3.77Å; F114-M200 HydrophobicContact CZ-SD 4.17Å; F171-M200 HydrophobicContact CE1-CE 4.08Å; F171-M200 HydrophobicContact CE1-SD 4.32Å; F171-M200 HydrophobicContact CZ-CE 4.37Å; L175-M200 HydrophobicContact CD2-CE 3.65Å; D196-M200 WeakPolarHBondContact O-CG 3.39Å; D196-M200 PolarHBondContact O-N 3.4Å; F197-M200 PolarHBondContact O-N 3.38Å; M200-I203 PolarHBondContact O-N 3.43Å; M200-L204 HydrophobicContact CE-CD1 3.96Å; M200-L204 HydrophobicContact CE-CG 4.37Å; M200-L204 VanDerWaalsContact O-CB 3.24Å; M200-L204 WeakPolarHBondContact O-CB 3.27Å; M200-L204 VanDerWaalsContact O-CG 3.27Å; M200-L204 WeakPolarHBondContact O-CG 3.34Å; M200-L204 PolarHBondContact O-N 2.89Å; M200-F224 HydrophobicContact CB-CE2 4.16Å; M200-F224 HydrophobicContact CB-CZ 3.88Å; M200-F224 HydrophobicContact CE-CZ 4.2Å; M200-F224 HydrophobicContact CG-CZ 4.46Å
201	I	98.4	Very high	97.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-69.7	-40.5	177.6	-64.6	-69.8	0	0	0	111.4	F197 G198 Y199 I203 S205 L209 F216 T219 Y223 F224	F197-I201 WeakPolarHBondContact O-CB 3.36Å; F197-I201 WeakPolarHBondContact O-CG1 3.33Å; F197-I201 PolarHBondContact O-N 2.84Å; G198-I201 PolarHBondContact O-N 3.29Å; Y199-I201 PolarHBondContact O-N 2.83Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 2.86Å; I201-S205 VanDerWaalsContact O-CB 3.27Å; I201-S205 WeakPolarHBondContact O-CB 3.16Å; I201-S205 PolarHBondContact O-N 3.28Å; I201-S205 PolarHBondContact O-OG 2.72Å; I201-L209 HydrophobicContact CB-CD2 3.86Å; I201-L209 HydrophobicContact CG2-CD2 3.64Å; I201-F216 HydrophobicContact CB-CE2 4.37Å; I201-F216 HydrophobicContact CG1-CE2 4.17Å; I201-T219 HydrophobicContact CD1-CG2 4.28Å; I201-T219 HydrophobicContact CG2-CG2 3.67Å; I201-Y223 HydrophobicContact CD1-CD2 3.5Å; I201-Y223 VanDerWaalsContact CD1-CD2 3.5Å; I201-Y223 HydrophobicContact CD1-CE2 4.35Å; I201-Y223 HydrophobicContact CD1-CG 3.97Å; I201-F224 HydrophobicContact CD1-CD2 3.99Å; I201-F224 HydrophobicContact CD1-CE2 3.78Å; I201-F224 HydrophobicContact CG1-CE2 4.32Å
202	K	98.3	Very high	97.3	Very high	44 Å²	44	37.3 Å²	37.3	19%	0.191	21%	0.207	C	C	.	.	H	α-helix	trans	-55.2	-46.6	171.7	175.8	-175.3	178	-176.7	0	111	V104 H105 L107 G198 Y199 G206 L209	V104-K202 HydrophobicContact CG1-CB 4.17Å; V104-K202 HydrophobicContact CG1-CD 3.93Å; V104-K202 WeakPolarHBondContact O-CD 3.42Å; V104-K202 WeakPolarHBondContact O-CE 3.42Å; V104-K202 PolarHBondContact O-NZ 2.82Å; H105-K202 PolarHBondContact O-NZ 3.18Å; L107-K202 PolarHBondContact O-NZ 3.04Å; G198-K202 WeakPolarHBondContact O-CB 3.3Å; G198-K202 PolarHBondContact O-N 3.11Å; Y199-K202 PolarHBondContact O-N 3.04Å; K202-G206 PolarHBondContact O-N 2.78Å; K202-G206 VanDerWaalsContact O-N 3.16Å; K202-L209 HydrophobicContact CB-CD2 4.33Å
203	I	98.4	Very high	97.2	Very high	21 Å²	21	35 Å²	35	11%	0.108	20%	0.196	C	C	.	.	H	α-helix	trans	-72	-46.2	-176.9	-70.2	168.2	0	0	0	111.9	L109 T168 F171 A172 Y199 M200 I201	L109-I203 HydrophobicContact CB-CD1 4.12Å; L109-I203 HydrophobicContact CD2-CD1 3.43Å; L109-I203 VanDerWaalsContact CD2-CD1 3.43Å; L109-I203 HydrophobicContact CG-CD1 4.44Å; T168-I203 HydrophobicContact CG2-CD1 3.89Å; T168-I203 HydrophobicContact CG2-CG1 4.22Å; F171-I203 HydrophobicContact CD1-CG2 3.93Å; F171-I203 HydrophobicContact CE1-CG2 4.37Å; A172-I203 HydrophobicContact CB-CG2 3.91Å; A172-I203 VanDerWaalsContact CB-O 3.32Å; A172-I203 WeakPolarHBondContact CB-O 3.42Å; Y199-I203 WeakPolarHBondContact O-CB 3.42Å; Y199-I203 VanDerWaalsContact O-CG1 3.26Å; Y199-I203 WeakPolarHBondContact O-CG1 3.44Å; Y199-I203 PolarHBondContact O-N 2.83Å; M200-I203 PolarHBondContact O-N 3.43Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 2.86Å
204	L	98.4	Very high	97	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-74.1	-29.6	-176.3	-74.2	169.4	0	0	0	114.1	L175 L176 V181 M200 Y223 F224	L175-L204 HydrophobicContact CB-CD2 4.39Å; L175-L204 HydrophobicContact CD2-CD2 4.12Å; L175-L204 HydrophobicContact CG-CD2 4.43Å; L176-L204 HydrophobicContact CD2-CD2 3.82Å; L176-L204 HydrophobicContact CG-CD2 3.93Å; V181-L204 HydrophobicContact CG1-CD1 4.02Å; V181-L204 HydrophobicContact CG2-CD2 4.33Å; M200-L204 HydrophobicContact CE-CD1 3.96Å; M200-L204 HydrophobicContact CE-CG 4.37Å; M200-L204 VanDerWaalsContact O-CB 3.24Å; M200-L204 WeakPolarHBondContact O-CB 3.27Å; M200-L204 VanDerWaalsContact O-CG 3.27Å; M200-L204 WeakPolarHBondContact O-CG 3.34Å; M200-L204 PolarHBondContact O-N 2.89Å; L204-Y223 HydrophobicContact CB-CD1 3.96Å; L204-Y223 HydrophobicContact CB-CE1 3.74Å; L204-Y223 HydrophobicContact CD1-CD1 3.99Å; L204-Y223 HydrophobicContact CD1-CG 4.37Å; L204-Y223 HydrophobicContact CG-CD1 4.49Å; L204-Y223 PolarHBondContact O-OH 2.88Å; L204-F224 HydrophobicContact CD1-CE2 3.94Å; L204-F224 HydrophobicContact CD1-CZ 3.57Å
205	S	96.9	Very high	96.9	Very high	34 Å²	34	38.7 Å²	38.7	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-83.2	-29	174.3	64.7	0	0	0	0	112.8	I201 L207 Y223	I201-S205 VanDerWaalsContact O-CB 3.27Å; I201-S205 WeakPolarHBondContact O-CB 3.16Å; I201-S205 PolarHBondContact O-N 3.28Å; I201-S205 PolarHBondContact O-OG 2.72Å; S205-L207 PolarHBondContact O-N 3.02Å; S205-L207 PolarHBondContact OG-N 2.92Å; S205-L207 VanDerWaalsContact OG-N 3.14Å; S205-Y223 WeakPolarHBondContact CA-OH 3.35Å
206	G	96.2	Very high	96.9	Very high	66 Å²	66	36.8 Å²	36.8	68%	0.68	22%	0.216	S	C	*	.	S	Bend	trans	66.8	14.1	-167.7	0	0	0	0	0	113.4	K202	K202-G206 PolarHBondContact O-N 2.78Å; K202-G206 VanDerWaalsContact O-N 3.16Å
207	L	95.7	Very high	96.7	Very high	119 Å²	119	38.2 Å²	38.2	62%	0.623	22%	0.221	S	C	*	.	S	Bend	trans	-118	168.7	-175.9	-61.7	177.7	0	0	0	111.2	S205	S205-L207 PolarHBondContact O-N 3.02Å; S205-L207 PolarHBondContact OG-N 2.92Å; S205-L207 VanDerWaalsContact OG-N 3.14Å
208	M	95.3	Very high	96.7	Very high	118 Å²	118	44.8 Å²	44.8	58%	0.581	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-66.5	140.8	163.9	-65.3	-58.5	97.3	0	0	109.6	H105	H105-M208 HydrophobicContact CB-SD 4.29Å
209	L	97.6	Very high	96.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-53.1	144.7	169.9	-62.5	-179.5	0	0	0	111.1	M100 R101 V104 H105 G198 I201 K202 F216	M100-L209 HydrophobicContact CE-CD1 4.17Å; R101-L209 PolarHBondContact NH1-O 3.31Å; V104-L209 HydrophobicContact CB-CD1 4.09Å; V104-L209 HydrophobicContact CG1-CD1 3.74Å; V104-L209 HydrophobicContact CG1-CG 4.44Å; H105-L209 WeakPolarHBondContact NE2-CB 3.25Å; H105-L209 PolarHBondContact NE2-N 3.05Å; G198-L209 WeakPolarHBondContact O-CD2 3.43Å; I201-L209 HydrophobicContact CB-CD2 3.86Å; I201-L209 HydrophobicContact CG2-CD2 3.64Å; K202-L209 HydrophobicContact CB-CD2 4.33Å; L209-F216 HydrophobicContact CD2-CD2 4.33Å; L209-F216 HydrophobicContact CD2-CE2 4.44Å
210	P	96.8	Very high	96.6	Very high	36 Å²	36	46.4 Å²	46.4	23%	0.234	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-49.3	163	178.8	-31.6	38.2	0	0	0	114.5	Y97 R101 T212	Y97-P210 PolarHBondContact OH-O 3.02Å; R101-P210 WeakPolarHBondContact CD-O 3.36Å; R101-P210 PolarHBondContact NH1-O 3.23Å; P210-T212 VanDerWaalsContact C-N 3.32Å
211	E	94.4	Very high	96.5	Very high	152 Å²	152	53.6 Å²	53.6	71%	0.71	29%	0.293	S	S	*	.	S	Bend	trans	-78.5	-17	179.1	-70.6	172.8	-171.4	0	0	113.7	Q98	Q98-E211 PolarHBondContact NE2-O 3.43Å
212	T	93.6	Very high	96.5	Very high	50 Å²	50	59.1 Å²	59.1	31%	0.307	32%	0.323	S	S	.	.	S	Bend	trans	-126.9	146.6	-173	58.9	0	0	0	0	112	Y97 P210 S214 G215 F216	Y97-T212 VanDerWaalsContact CE1-C 3.42Å; P210-T212 VanDerWaalsContact C-N 3.32Å; T212-S214 PolarHBondContact O-N 3.08Å; T212-S214 PolarHBondContact OG1-OG 3.26Å; T212-G215 PolarHBondContact O-N 3.09Å; T212-G215 VanDerWaalsContact O-N 3.14Å; T212-G215 PolarHBondContact OG1-N 3.07Å; T212-F216 PolarHBondContact O-N 2.67Å
213	E	94.2	Very high	96.5	Very high	31 Å²	31	58.9 Å²	58.9	15%	0.145	32%	0.321	C	S	.	.	H	α-helix	trans	-48.3	-46.9	171.9	-170.6	-154	139.6	0	0	110.8	Y97 F216 F217 L297 S299	Y97-E213 HydrophobicContact CD1-CB 4.35Å; Y97-E213 HydrophobicContact CD2-CB 4.36Å; Y97-E213 HydrophobicContact CG-CB 4.02Å; Y97-E213 HydrophobicContact CG-CG 4.46Å; E213-F216 WeakPolarHBondContact O-CB 3.38Å; E213-F216 PolarHBondContact O-N 3.01Å; E213-F217 HydrophobicContact CG-CD2 3.96Å; E213-F217 HydrophobicContact CG-CE2 3.8Å; E213-F217 VanDerWaalsContact O-CD2 3.29Å; E213-F217 WeakPolarHBondContact O-CD2 3.35Å; E213-F217 PolarHBondContact O-N 3.07Å; E213-L297 VanDerWaalsContact CD-O 3.28Å; E213-S299 PolarHBondContact OE1-N 3.16Å; E213-S299 PolarHBondContact OE2-OG 3.14Å
214	S	93.9	Very high	96.5	Very high	72 Å²	72	58 Å²	58	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-46.2	179.3	49.5	0	0	0	0	113.3	T212 F216 F217 E218	T212-S214 PolarHBondContact O-N 3.08Å; T212-S214 PolarHBondContact OG1-OG 3.26Å; S214-F216 VanDerWaalsContact C-N 3.27Å; S214-F216 PolarHBondContact O-N 3.31Å; S214-F217 PolarHBondContact O-N 2.79Å; S214-F217 VanDerWaalsContact O-N 3.17Å; S214-E218 WeakPolarHBondContact O-CG 3.44Å; S214-E218 PolarHBondContact O-N 3.31Å
215	G	95.9	Very high	96.4	Very high	11 Å²	11	59.2 Å²	59.2	11%	0.113	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-31.6	177.7	0	0	0	0	0	112.6	T212 T219	T212-G215 PolarHBondContact O-N 3.09Å; T212-G215 VanDerWaalsContact O-N 3.14Å; T212-G215 PolarHBondContact OG1-N 3.07Å; G215-T219 WeakPolarHBondContact O-CB 3.45Å; G215-T219 PolarHBondContact O-N 2.81Å; G215-T219 PolarHBondContact O-OG1 3.25Å
216	F	97.1	Very high	96.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-66.7	-45.2	170.5	169.6	-100.6	0	0	0	112.2	Y97 M100 F197 I201 L209 T212 E213 S214 E218 T219 L220 L294 L297	Y97-F216 HydrophobicContact CD2-CB 4.43Å; Y97-F216 HydrophobicContact CD2-CD1 4.42Å; Y97-F216 HydrophobicContact CE2-CB 3.4Å; Y97-F216 VanDerWaalsContact CE2-CB 3.4Å; Y97-F216 AromaticContact CE2-CD1 3.92Å; Y97-F216 HydrophobicContact CE2-CD1 3.92Å; Y97-F216 HydrophobicContact CE2-CD2 4.24Å; Y97-F216 AromaticContact CE2-CG 3.6Å; Y97-F216 HydrophobicContact CE2-CG 3.6Å; Y97-F216 WeakPolarHBondContact OH-CB 3.32Å; M100-F216 HydrophobicContact CE-CE1 4.48Å; M100-F216 HydrophobicContact CE-CE2 4.32Å; M100-F216 HydrophobicContact CE-CZ 4.29Å; F197-F216 HydrophobicContact CB-CZ 4.15Å; I201-F216 HydrophobicContact CB-CE2 4.37Å; I201-F216 HydrophobicContact CG1-CE2 4.17Å; L209-F216 HydrophobicContact CD2-CD2 4.33Å; L209-F216 HydrophobicContact CD2-CE2 4.44Å; T212-F216 PolarHBondContact O-N 2.67Å; E213-F216 WeakPolarHBondContact O-CB 3.38Å; E213-F216 PolarHBondContact O-N 3.01Å; S214-F216 VanDerWaalsContact C-N 3.27Å; S214-F216 PolarHBondContact O-N 3.31Å; F216-E218 VanDerWaalsContact C-N 3.34Å; F216-E218 PolarHBondContact O-N 2.96Å; F216-T219 PolarHBondContact O-N 3.47Å; F216-L220 VanDerWaalsContact O-CB 3.3Å; F216-L220 WeakPolarHBondContact O-CB 3.5Å; F216-L220 PolarHBondContact O-N 3.42Å; F216-L294 HydrophobicContact CE1-CD1 4.05Å; F216-L294 HydrophobicContact CZ-CD1 4.37Å; F216-L297 HydrophobicContact CE1-CD1 3.99Å
217	F	96.4	Very high	96.5	Very high	38 Å²	38	56.5 Å²	56.5	17%	0.167	29%	0.293	C	S	.	.	H	α-helix	trans	-65.3	-34.1	176	-83.1	-74.8	0	0	0	113.2	E213 S214 L220 K221 G292 L294 L297 S298	E213-F217 HydrophobicContact CG-CD2 3.96Å; E213-F217 HydrophobicContact CG-CE2 3.8Å; E213-F217 VanDerWaalsContact O-CD2 3.29Å; E213-F217 WeakPolarHBondContact O-CD2 3.35Å; E213-F217 PolarHBondContact O-N 3.07Å; S214-F217 PolarHBondContact O-N 2.79Å; S214-F217 VanDerWaalsContact O-N 3.17Å; F217-L220 HydrophobicContact CD1-CD2 3.76Å; F217-L220 HydrophobicContact CE1-CD2 3.91Å; F217-K221 WeakPolarHBondContact O-CB 3.35Å; F217-K221 PolarHBondContact O-N 3.35Å; F217-G292 WeakPolarHBondContact CE1-O 3.49Å; F217-L294 HydrophobicContact CE1-CB 4.35Å; F217-L294 HydrophobicContact CE1-CD1 4.32Å; F217-L294 HydrophobicContact CE1-CG 3.94Å; F217-L294 HydrophobicContact CZ-CB 4.2Å; F217-L294 HydrophobicContact CZ-CD1 4.49Å; F217-L294 HydrophobicContact CZ-CG 4.24Å; F217-L297 HydrophobicContact CE2-CB 4.05Å; F217-L297 HydrophobicContact CZ-CB 3.97Å; F217-S298 WeakPolarHBondContact CE1-OG 3.46Å; F217-S298 WeakPolarHBondContact CZ-OG 3.35Å
218	E	96.8	Very high	96.6	Very high	138 Å²	138	51.7 Å²	51.7	65%	0.645	27%	0.266	S	S	*	.	H	α-helix	trans	-61.1	-47.2	170.1	-73.7	172.5	-173.6	0	0	111.2	S214 F216 K221 L222	S214-E218 WeakPolarHBondContact O-CG 3.44Å; S214-E218 PolarHBondContact O-N 3.31Å; F216-E218 VanDerWaalsContact C-N 3.34Å; F216-E218 PolarHBondContact O-N 2.96Å; E218-K221 PolarHBondContact O-N 3.31Å; E218-L222 WeakPolarHBondContact O-CG 3.44Å; E218-L222 PolarHBondContact O-N 2.91Å
219	T	97.3	Very high	96.7	Very high	33 Å²	33	46 Å²	46	20%	0.202	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-41.7	178.4	-49.4	0	0	0	0	111.6	I201 G215 F216 K221 L222 Y223	I201-T219 HydrophobicContact CD1-CG2 4.28Å; I201-T219 HydrophobicContact CG2-CG2 3.67Å; G215-T219 WeakPolarHBondContact O-CB 3.45Å; G215-T219 PolarHBondContact O-N 2.81Å; G215-T219 PolarHBondContact O-OG1 3.25Å; F216-T219 PolarHBondContact O-N 3.47Å; T219-K221 VanDerWaalsContact C-N 3.33Å; T219-K221 PolarHBondContact O-N 3.16Å; T219-L222 WeakPolarHBondContact O-CB 3.3Å; T219-L222 PolarHBondContact O-N 3.29Å; T219-Y223 HydrophobicContact CG2-CD2 4.07Å; T219-Y223 HydrophobicContact CG2-CE2 3.92Å; T219-Y223 WeakPolarHBondContact O-CD2 3.42Å; T219-Y223 PolarHBondContact O-N 3.44Å
220	L	97.7	Very high	96.7	Very high	3 Å²	3	46 Å²	46	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-54.3	-50.3	175.1	-179	73.1	0	0	0	110.6	F197 F216 F217 L222 Y223 F224 L294	F197-L220 HydrophobicContact CB-CD1 3.64Å; F197-L220 HydrophobicContact CD1-CD1 3.58Å; F197-L220 HydrophobicContact CD2-CD1 4.27Å; F197-L220 HydrophobicContact CE1-CD1 4.29Å; F197-L220 HydrophobicContact CG-CD1 3.57Å; F216-L220 VanDerWaalsContact O-CB 3.3Å; F216-L220 WeakPolarHBondContact O-CB 3.5Å; F216-L220 PolarHBondContact O-N 3.42Å; F217-L220 HydrophobicContact CD1-CD2 3.76Å; F217-L220 HydrophobicContact CE1-CD2 3.91Å; L220-L222 PolarHBondContact O-N 3.01Å; L220-Y223 PolarHBondContact O-N 2.84Å; L220-F224 HydrophobicContact CD1-CB 4.46Å; L220-F224 HydrophobicContact CD1-CD2 3.95Å; L220-F224 CarbonylContact O-C 3.46Å; L220-F224 WeakPolarHBondContact O-CA 3.15Å; L220-F224 WeakPolarHBondContact O-CB 3.37Å; L220-F224 PolarHBondContact O-N 2.63Å; L220-L294 HydrophobicContact CD2-CD1 3.88Å; L220-L294 HydrophobicContact CD2-CD2 4.48Å; L220-L294 HydrophobicContact CD2-CG 4.14Å
221	K	97.3	Very high	96.7	Very high	151 Å²	151	45.7 Å²	45.7	66%	0.657	23%	0.233	S	C	*	.	H	α-helix	trans	-63.8	-26	-178.5	-173.5	173.2	-178.7	176	0	113.5	F217 E218 T219 P225	F217-K221 WeakPolarHBondContact O-CB 3.35Å; F217-K221 PolarHBondContact O-N 3.35Å; E218-K221 PolarHBondContact O-N 3.31Å; T219-K221 VanDerWaalsContact C-N 3.33Å; T219-K221 PolarHBondContact O-N 3.16Å; K221-P225 WeakPolarHBondContact O-CA 3.46Å
222	L	97.6	Very high	96.7	Very high	118 Å²	118	38.9 Å²	38.9	62%	0.618	20%	0.202	S	C	*	.	H	α-helix	trans	-70.3	-51.4	173.6	-66.1	172.6	0	0	0	111.2	E218 T219 L220	E218-L222 WeakPolarHBondContact O-CG 3.44Å; E218-L222 PolarHBondContact O-N 2.91Å; T219-L222 WeakPolarHBondContact O-CB 3.3Å; T219-L222 PolarHBondContact O-N 3.29Å; L220-L222 PolarHBondContact O-N 3.01Å
223	Y	98.4	Very high	96.8	Very high	39 Å²	39	36.5 Å²	36.5	15%	0.153	19%	0.187	C	C	.	.	H	α-helix	trans	-77.3	-31.8	-177.2	-72.5	-79.7	0	0	0	113.6	L176 L182 I201 L204 S205 T219 L220	L176-Y223 HydrophobicContact CD2-CD1 4.37Å; L176-Y223 HydrophobicContact CD2-CE1 3.74Å; L182-Y223 HydrophobicContact CD2-CD1 3.71Å; L182-Y223 HydrophobicContact CD2-CE1 4.03Å; L182-Y223 HydrophobicContact CD2-CG 4.22Å; L182-Y223 HydrophobicContact CG-CD1 4.05Å; L182-Y223 HydrophobicContact CG-CE1 4.48Å; L182-Y223 PolarHBondContact N-O 3.03Å; I201-Y223 HydrophobicContact CD1-CD2 3.5Å; I201-Y223 VanDerWaalsContact CD1-CD2 3.5Å; I201-Y223 HydrophobicContact CD1-CE2 4.35Å; I201-Y223 HydrophobicContact CD1-CG 3.97Å; L204-Y223 HydrophobicContact CB-CD1 3.96Å; L204-Y223 HydrophobicContact CB-CE1 3.74Å; L204-Y223 HydrophobicContact CD1-CD1 3.99Å; L204-Y223 HydrophobicContact CD1-CG 4.37Å; L204-Y223 HydrophobicContact CG-CD1 4.49Å; L204-Y223 PolarHBondContact O-OH 2.88Å; S205-Y223 WeakPolarHBondContact CA-OH 3.35Å; T219-Y223 HydrophobicContact CG2-CD2 4.07Å; T219-Y223 HydrophobicContact CG2-CE2 3.92Å; T219-Y223 WeakPolarHBondContact O-CD2 3.42Å; T219-Y223 PolarHBondContact O-N 3.44Å; L220-Y223 PolarHBondContact O-N 2.84Å
224	F	98.3	Very high	96.7	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.013	18%	0.182	C	C	.	.			trans	-133.7	77.5	-173.6	-53.7	-81.4	0	0	0	109.4	V181 W188 F197 M200 I201 L204 L220 V226 V227	V181-F224 HydrophobicContact CG1-CD1 4.46Å; V181-F224 HydrophobicContact CG1-CE1 3.76Å; V181-F224 HydrophobicContact CG1-CZ 4.13Å; W188-F224 AromaticContact CD1-CD1 3.84Å; W188-F224 AromaticContact CD2-CD1 3.57Å; W188-F224 HydrophobicContact CD2-CD1 3.57Å; W188-F224 AromaticContact CD2-CE1 3.88Å; W188-F224 HydrophobicContact CD2-CE1 3.88Å; W188-F224 AromaticContact CE2-CD1 3.48Å; W188-F224 VanDerWaalsContact CE2-CD1 3.48Å; W188-F224 AromaticContact CE2-CE1 3.68Å; W188-F224 HydrophobicContact CE3-CD1 4.14Å; W188-F224 HydrophobicContact CE3-CE1 4.06Å; W188-F224 AromaticContact CG-CD1 3.81Å; W188-F224 HydrophobicContact CG-CD1 3.81Å; W188-F224 HydrophobicContact CH2-CD1 4.49Å; W188-F224 AromaticContact CH2-CE1 3.87Å; W188-F224 HydrophobicContact CH2-CE1 3.87Å; W188-F224 AromaticContact CZ2-CD1 3.97Å; W188-F224 HydrophobicContact CZ2-CD1 3.97Å; W188-F224 AromaticContact CZ2-CE1 3.67Å; W188-F224 HydrophobicContact CZ2-CE1 3.67Å; W188-F224 HydrophobicContact CZ3-CE1 4.06Å; W188-F224 AromaticContact NE1-CD1 3.64Å; F197-F224 HydrophobicContact CD1-CD1 4.4Å; F197-F224 AromaticContact CD1-CD2 3.84Å; F197-F224 HydrophobicContact CD1-CD2 3.84Å; F197-F224 HydrophobicContact CD1-CE1 4.48Å; F197-F224 AromaticContact CD1-CE2 3.93Å; F197-F224 HydrophobicContact CD1-CE2 3.93Å; F197-F224 HydrophobicContact CD1-CG 4.08Å; F197-F224 HydrophobicContact CD1-CZ 4.26Å; F197-F224 HydrophobicContact CE1-CB 4.23Å; F197-F224 AromaticContact CE1-CD1 3.78Å; F197-F224 HydrophobicContact CE1-CD1 3.78Å; F197-F224 AromaticContact CE1-CD2 3.98Å; F197-F224 HydrophobicContact CE1-CD2 3.98Å; F197-F224 HydrophobicContact CE1-CE1 4.08Å; F197-F224 HydrophobicContact CE1-CE2 4.27Å; F197-F224 AromaticContact CE1-CG 3.72Å; F197-F224 HydrophobicContact CE1-CG 3.72Å; F197-F224 HydrophobicContact CE1-CZ 4.31Å; M200-F224 HydrophobicContact CB-CE2 4.16Å; M200-F224 HydrophobicContact CB-CZ 3.88Å; M200-F224 HydrophobicContact CE-CZ 4.2Å; M200-F224 HydrophobicContact CG-CZ 4.46Å; I201-F224 HydrophobicContact CD1-CD2 3.99Å; I201-F224 HydrophobicContact CD1-CE2 3.78Å; I201-F224 HydrophobicContact CG1-CE2 4.32Å; L204-F224 HydrophobicContact CD1-CE2 3.94Å; L204-F224 HydrophobicContact CD1-CZ 3.57Å; L220-F224 HydrophobicContact CD1-CB 4.46Å; L220-F224 HydrophobicContact CD1-CD2 3.95Å; L220-F224 CarbonylContact O-C 3.46Å; L220-F224 WeakPolarHBondContact O-CA 3.15Å; L220-F224 WeakPolarHBondContact O-CB 3.37Å; L220-F224 PolarHBondContact O-N 2.63Å; F224-V226 VanDerWaalsContact C-N 3.28Å; F224-V226 PolarHBondContact O-N 3.18Å; F224-V227 HydrophobicContact CB-CG2 3.66Å
225	P	97	Very high	96.5	Very high	29 Å²	29	36.5 Å²	36.5	19%	0.188	18%	0.182	C	C	.	.	S	Bend	trans	-63.9	-29	-170.3	-25.5	36.3	0	0	0	114.7	D184 K221	D184-P225 WeakPolarHBondContact OD1-CB 3.32Å; D184-P225 WeakPolarHBondContact OD1-CG 3.41Å; K221-P225 WeakPolarHBondContact O-CA 3.46Å
226	V	96.6	Very high	96.1	Very high	43 Å²	43	36 Å²	36	26%	0.261	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	113.7	178.4	-163.7	0	0	0	0	109.6	L187 W188 F224	L187-V226 HydrophobicContact CD1-CB 4.19Å; L187-V226 HydrophobicContact CD1-CG1 3.59Å; W188-V226 PolarHBondContact N-O 3.15Å; F224-V226 VanDerWaalsContact C-N 3.28Å; F224-V226 PolarHBondContact O-N 3.18Å
227	V	98.2	Very high	95.6	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.4	-179.7	179.5	0	0	0	0	109.9	W188 F197 F224 A291 G292 L294	W188-V227 HydrophobicContact CB-CG2 4.17Å; W188-V227 CarbonylContact O-C 3.56Å; W188-V227 WeakPolarHBondContact O-CA 3.43Å; F197-V227 HydrophobicContact CE1-CG2 4.34Å; F197-V227 HydrophobicContact CE2-CG1 3.53Å; F197-V227 HydrophobicContact CE2-CG2 4.46Å; F197-V227 HydrophobicContact CZ-CB 4.46Å; F197-V227 HydrophobicContact CZ-CG1 3.62Å; F197-V227 HydrophobicContact CZ-CG2 3.92Å; F224-V227 HydrophobicContact CB-CG2 3.66Å; V227-A291 CarbonylContact O-C 3.58Å; V227-A291 WeakPolarHBondContact O-CA 3.37Å; V227-G292 PolarHBondContact O-N 3.24Å; V227-L294 HydrophobicContact CG1-CD2 3.89Å
228	Y	98.2	Very high	94.8	Very high	17 Å²	17	38.7 Å²	38.7	7%	0.067	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.6	160.4	-69	-52.8	0	0	0	110.5	L187 W188 L189 S190 L233 F273 I285 P287 A291	L187-Y228 HydrophobicContact CD1-CD2 3.6Å; L187-Y228 HydrophobicContact CD1-CE2 3.85Å; L187-Y228 HydrophobicContact CD1-CG 4.45Å; L187-Y228 HydrophobicContact CD2-CD2 4.23Å; L187-Y228 HydrophobicContact CD2-CE2 4.27Å; L187-Y228 HydrophobicContact CG-CD2 4.48Å; W188-Y228 PolarHBondContact O-N 3.32Å; L189-Y228 WeakPolarHBondContact CA-O 3.4Å; L189-Y228 HydrophobicContact CD2-CD2 4.2Å; S190-Y228 PolarHBondContact N-O 2.81Å; S190-Y228 PolarHBondContact OG-O 2.89Å; Y228-L233 HydrophobicContact CG-CD1 4.35Å; Y228-F273 AromaticContact CD2-CE2 3.73Å; Y228-F273 HydrophobicContact CD2-CE2 3.73Å; Y228-F273 AromaticContact CD2-CZ 3.79Å; Y228-F273 HydrophobicContact CD2-CZ 3.79Å; Y228-F273 HydrophobicContact CE2-CZ 4.36Å; Y228-F273 HydrophobicContact CG-CE2 4.1Å; Y228-I285 HydrophobicContact CD1-CG2 4.26Å; Y228-I285 HydrophobicContact CE1-CG2 3.67Å; Y228-I285 HydrophobicContact CE2-CG2 4.31Å; Y228-P287 WeakPolarHBondContact OH-CA 3.48Å; Y228-A291 HydrophobicContact CD1-CB 4.43Å; Y228-A291 HydrophobicContact CE1-CB 3.79Å
229	D	98	Very high	94	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	115.7	164.3	-177.2	-17.6	0	0	0	108.9	H192 S193 K231 H232 L233 Y293 L294 Y295	H192-D229 WeakPolarHBondContact CA-OD2 3.43Å; H192-D229 PolarHBondContact N-OD1 3.48Å; H192-D229 PolarHBondContact N-OD2 3.33Å; S193-D229 PolarHBondContact N-OD2 3.12Å; D229-K231 PolarHBondContact O-N 3.21Å; D229-K231 WeakPolarHBondContact OD1-CA 3.3Å; D229-K231 WeakPolarHBondContact OD1-CB 3.38Å; D229-K231 PolarHBondContact OD1-N 3.42Å; D229-H232 HydrophobicContact CB-CB 3.9Å; D229-H232 WeakPolarHBondContact O-CB 3.44Å; D229-H232 PolarHBondContact O-N 3.44Å; D229-H232 PolarHBondContact OD1-N 2.78Å; D229-L233 PolarHBondContact O-N 3.25Å; D229-Y293 WeakPolarHBondContact CB-O 3.4Å; D229-L294 HydrophobicContact CB-CD2 4.34Å; D229-Y295 VanDerWaalsContact OD2-CB 3.25Å; D229-Y295 WeakPolarHBondContact OD2-CB 3.26Å; D229-Y295 PolarHBondContact OD2-N 3.12Å
230	V	97.5	Very high	93.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-37.5	177.7	170	0	0	0	0	111.1	S190 F191 H232 L233 M234 T269 T272 F273 M276	S190-V230 WeakPolarHBondContact O-CB 3.5Å; S190-V230 WeakPolarHBondContact O-CG2 3.43Å; S190-V230 PolarHBondContact O-N 3.41Å; F191-V230 HydrophobicContact CD2-CB 3.91Å; F191-V230 HydrophobicContact CD2-CG1 3.84Å; F191-V230 HydrophobicContact CE2-CG1 4.31Å; V230-H232 VanDerWaalsContact C-N 3.32Å; V230-H232 PolarHBondContact O-N 3.26Å; V230-L233 PolarHBondContact O-N 3.33Å; V230-M234 VanDerWaalsContact O-CG 3.3Å; V230-M234 WeakPolarHBondContact O-CG 3.49Å; V230-M234 PolarHBondContact O-N 3.44Å; V230-T269 HydrophobicContact CG2-CG2 4.42Å; V230-T272 HydrophobicContact CG1-CG2 4.34Å; V230-F273 HydrophobicContact CG2-CB 3.71Å; V230-F273 HydrophobicContact CG2-CD2 4.04Å; V230-F273 HydrophobicContact CG2-CG 4.37Å; V230-M276 HydrophobicContact CB-CE 4.33Å; V230-M276 HydrophobicContact CG1-CE 3.84Å; V230-M276 HydrophobicContact CG1-SD 4.26Å; V230-M276 HydrophobicContact CG2-CE 4.36Å
231	K	96.4	Very high	93.2	Very high	30 Å²	30	43.1 Å²	43.1	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-35.6	176.1	-169.2	82	-167	-162	0	111.6	F191 H192 D229 M234 G242 Y295	F191-K231 HydrophobicContact CD2-CB 4.04Å; F191-K231 HydrophobicContact CE1-CD 3.95Å; F191-K231 HydrophobicContact CE2-CB 3.9Å; F191-K231 HydrophobicContact CE2-CD 3.67Å; F191-K231 HydrophobicContact CE2-CG 4.4Å; F191-K231 HydrophobicContact CG-CB 4.46Å; F191-K231 HydrophobicContact CZ-CB 4.25Å; F191-K231 HydrophobicContact CZ-CD 3.32Å; F191-K231 HydrophobicContact CZ-CG 4.34Å; H192-K231 HydrophobicContact CB-CB 4.03Å; H192-K231 HydrophobicContact CB-CG 4.08Å; D229-K231 PolarHBondContact O-N 3.21Å; D229-K231 WeakPolarHBondContact OD1-CA 3.3Å; D229-K231 WeakPolarHBondContact OD1-CB 3.38Å; D229-K231 PolarHBondContact OD1-N 3.42Å; K231-M234 HydrophobicContact CD-SD 3.96Å; K231-G242 PolarHBondContact NZ-O 2.87Å; K231-Y295 HydrophobicContact CB-CD2 4.15Å; K231-Y295 HydrophobicContact CB-CG 4.08Å; K231-Y295 HydrophobicContact CG-CD1 3.91Å; K231-Y295 HydrophobicContact CG-CD2 3.42Å; K231-Y295 VanDerWaalsContact CG-CD2 3.42Å; K231-Y295 HydrophobicContact CG-CE1 4.22Å; K231-Y295 HydrophobicContact CG-CE2 3.78Å; K231-Y295 HydrophobicContact CG-CG 3.47Å; K231-Y295 VanDerWaalsContact CG-CG 3.47Å
232	H	94.6	Very high	93	Very high	10 Å²	10	36.9 Å²	36.9	5%	0.046	18%	0.182	C	C	.	.	H	α-helix	trans	-67.8	-46.8	172.9	177.3	80.1	0	0	0	111.4	D229 V230 M234 N235 G301	D229-H232 HydrophobicContact CB-CB 3.9Å; D229-H232 WeakPolarHBondContact O-CB 3.44Å; D229-H232 PolarHBondContact O-N 3.44Å; D229-H232 PolarHBondContact OD1-N 2.78Å; V230-H232 VanDerWaalsContact C-N 3.32Å; V230-H232 PolarHBondContact O-N 3.26Å; H232-M234 VanDerWaalsContact C-N 3.28Å; H232-M234 PolarHBondContact O-N 3.02Å; H232-N235 VanDerWaalsContact O-CB 3.32Å; H232-N235 WeakPolarHBondContact O-CB 3.46Å; H232-N235 PolarHBondContact O-N 3.43Å; H232-N235 PolarHBondContact O-ND2 3.22Å; H232-G301 PolarHBondContact CE1-O 3.27Å
233	L	94.9	Very high	92.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.2	-37.8	177.6	-75.4	169	0	0	0	112.9	Y228 D229 V230 N235 A236 F273 M276 F281 I285 Y290	Y228-L233 HydrophobicContact CG-CD1 4.35Å; D229-L233 PolarHBondContact O-N 3.25Å; V230-L233 PolarHBondContact O-N 3.33Å; L233-N235 PolarHBondContact O-N 3.01Å; L233-N235 VanDerWaalsContact O-N 3.14Å; L233-A236 WeakPolarHBondContact O-CB 3.31Å; L233-A236 PolarHBondContact O-N 2.98Å; L233-F273 HydrophobicContact CD1-CD2 3.95Å; L233-F273 HydrophobicContact CD1-CE2 3.79Å; L233-M276 HydrophobicContact CB-CE 3.5Å; L233-M276 HydrophobicContact CB-SD 4.33Å; L233-M276 HydrophobicContact CD1-CE 3.65Å; L233-M276 HydrophobicContact CG-CE 4.22Å; L233-F281 HydrophobicContact CB-CE2 4.39Å; L233-F281 HydrophobicContact CB-CZ 4.11Å; L233-F281 HydrophobicContact CD2-CE1 4.26Å; L233-F281 HydrophobicContact CD2-CE2 4.47Å; L233-F281 HydrophobicContact CD2-CZ 3.88Å; L233-I285 HydrophobicContact CD1-CD1 4Å; L233-I285 HydrophobicContact CD2-CD1 4.37Å; L233-I285 HydrophobicContact CD2-CG2 3.8Å; L233-Y290 HydrophobicContact CD2-CD1 3.72Å; L233-Y290 HydrophobicContact CD2-CD2 3.99Å; L233-Y290 HydrophobicContact CD2-CE1 4.26Å; L233-Y290 HydrophobicContact CD2-CG 3.53Å
234	M	93.8	Very high	92.9	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.034	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-56	-27.9	175.6	-71.4	163.6	66.5	0	0	114.1	F191 V230 K231 H232 A236 T237 L240 I247 M276	F191-M234 HydrophobicContact CE2-SD 3.91Å; V230-M234 VanDerWaalsContact O-CG 3.3Å; V230-M234 WeakPolarHBondContact O-CG 3.49Å; V230-M234 PolarHBondContact O-N 3.44Å; K231-M234 HydrophobicContact CD-SD 3.96Å; H232-M234 VanDerWaalsContact C-N 3.28Å; H232-M234 PolarHBondContact O-N 3.02Å; M234-A236 PolarHBondContact O-N 3.18Å; M234-T237 WeakPolarHBondContact O-CA 3.5Å; M234-T237 WeakPolarHBondContact O-CB 3.41Å; M234-T237 PolarHBondContact O-N 3.34Å; M234-T237 VanDerWaalsContact O-O 3.12Å; M234-T237 PolarHBondContact O-OG1 3.43Å; M234-L240 HydrophobicContact CB-CB 4.43Å; M234-L240 VanDerWaalsContact CE-C 3.5Å; M234-L240 HydrophobicContact CE-CB 4Å; M234-L240 WeakPolarHBondContact CE-O 3.48Å; M234-L240 HydrophobicContact CG-CB 4.08Å; M234-L240 HydrophobicContact CG-CD1 4.47Å; M234-I247 HydrophobicContact CE-CD1 3.44Å; M234-I247 VanDerWaalsContact CE-CD1 3.44Å; M234-I247 HydrophobicContact CE-CG1 3.64Å; M234-I247 HydrophobicContact SD-CD1 3.21Å; M234-I247 WeakPolarHBondContact SD-CD1 3.39Å; M234-I247 HydrophobicContact SD-CG1 3.95Å; M234-M276 HydrophobicContact CG-SD 4.15Å
235	N	89.6	Confident	92.8	Very high	95 Å²	95	33 Å²	33	51%	0.508	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-63	-22.7	178.8	-64.9	-41.4	0	0	0	112.3	H232 L233 T237	H232-N235 VanDerWaalsContact O-CB 3.32Å; H232-N235 WeakPolarHBondContact O-CB 3.46Å; H232-N235 PolarHBondContact O-N 3.43Å; H232-N235 PolarHBondContact O-ND2 3.22Å; L233-N235 PolarHBondContact O-N 3.01Å; L233-N235 VanDerWaalsContact O-N 3.14Å; N235-T237 VanDerWaalsContact C-N 3.28Å
236	A	87.2	Confident	92.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-82.2	-0.8	171.4	0	0	0	0	0	113.4	L233 M234 F281 Y290 V307	L233-A236 WeakPolarHBondContact O-CB 3.31Å; L233-A236 PolarHBondContact O-N 2.98Å; M234-A236 PolarHBondContact O-N 3.18Å; A236-F281 HydrophobicContact CB-CE1 4.36Å; A236-F281 HydrophobicContact CB-CZ 4.39Å; A236-Y290 HydrophobicContact CB-CE1 3.86Å; A236-Y290 WeakPolarHBondContact CB-OH 3.43Å; A236-V307 WeakPolarHBondContact O-CA 3.21Å; A236-V307 PolarHBondContact O-N 3.46Å
237	T	86.4	Confident	92.7	Very high	11 Å²	11	34.8 Å²	34.8	7%	0.067	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-114	133.2	-177.8	76	0	0	0	0	110.6	M234 N235 N239 L240 C280 F281	M234-T237 WeakPolarHBondContact O-CA 3.5Å; M234-T237 WeakPolarHBondContact O-CB 3.41Å; M234-T237 PolarHBondContact O-N 3.34Å; M234-T237 VanDerWaalsContact O-O 3.12Å; M234-T237 PolarHBondContact O-OG1 3.43Å; N235-T237 VanDerWaalsContact C-N 3.28Å; T237-N239 VanDerWaalsContact C-N 3.34Å; T237-N239 PolarHBondContact O-N 3.31Å; T237-L240 HydrophobicContact CG2-CD1 4.28Å; T237-L240 WeakPolarHBondContact OG1-CB 3.5Å; T237-L240 WeakPolarHBondContact OG1-CG 3.46Å; T237-C280 HydrophobicContact CG2-CB 3.77Å; T237-F281 HydrophobicContact CG2-CE2 4.35Å; T237-F281 HydrophobicContact CG2-CZ 4.38Å
238	K	79.8	Confident	92.6	Very high	85 Å²	85	34.7 Å²	34.7	37%	0.37	17%	0.172	S	C	.	.	S	Bend	trans	-64.4	-36	-176.9	-70.5	-170.3	168.2	175.6	0	114.5	E306 V308	K238-E306 WeakPolarHBondContact CE-OE1 3.17Å; K238-E306 WeakPolarHBondContact CE-OE2 3.48Å; K238-E306 HydrophobicContact CG-CG 4.21Å; K238-E306 IonicContact NZ-OE1 2.74Å; K238-E306 IonicContact NZ-OE2 3.15Å; K238-E306 PolarHBondContact NZ-OE2 3.45Å; K238-V308 HydrophobicContact CD-CG1 4.32Å; K238-V308 HydrophobicContact CD-CG2 3.86Å
239	N	79.9	Confident	92.6	Very high	79 Å²	79	38.7 Å²	38.7	42%	0.422	19%	0.194	S	C	.	.	S	Bend	trans	-112	-7.1	-158.9	-59.6	-12.7	0	0	0	113.9	T237 L309	T237-N239 VanDerWaalsContact C-N 3.34Å; T237-N239 PolarHBondContact O-N 3.31Å; N239-L309 HydrophobicContact CB-CD1 4.34Å
240	L	87.7	Confident	92.4	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.031	22%	0.217	C	C	.	.			trans	-95.6	118	179.3	-51.3	-178.7	0	0	0	110.2	M234 T237 I247 I250 L251 M276 L309	M234-L240 HydrophobicContact CB-CB 4.43Å; M234-L240 VanDerWaalsContact CE-C 3.5Å; M234-L240 HydrophobicContact CE-CB 4Å; M234-L240 WeakPolarHBondContact CE-O 3.48Å; M234-L240 HydrophobicContact CG-CB 4.08Å; M234-L240 HydrophobicContact CG-CD1 4.47Å; T237-L240 HydrophobicContact CG2-CD1 4.28Å; T237-L240 WeakPolarHBondContact OG1-CB 3.5Å; T237-L240 WeakPolarHBondContact OG1-CG 3.46Å; L240-I247 HydrophobicContact CD1-CG2 4.32Å; L240-I250 HydrophobicContact CD2-CG2 3.64Å; L240-L251 HydrophobicContact CD1-CD1 4.33Å; L240-L251 HydrophobicContact CD1-CD2 4.3Å; L240-L251 HydrophobicContact CD2-CD2 3.99Å; L240-L251 HydrophobicContact CD2-CG 4.39Å; L240-M276 HydrophobicContact CD1-CG 4.03Å; L240-M276 HydrophobicContact CD1-SD 4.06Å; L240-L309 HydrophobicContact CD2-CD1 4.44Å
241	R	90	Very high	92.3	Very high	181 Å²	181	43.4 Å²	43.4	68%	0.683	22%	0.218	S	C	*	.			trans	-142.2	172	173.1	-60.6	-173.4	-175.5	-165.5	0.7	107.9
242	G	93.5	Very high	92.3	Very high	21 Å²	21	50.1 Å²	50.1	22%	0.216	25%	0.25	C	C	.	.	S	Bend	trans	97.1	178.8	-177.3	0	0	0	0	0	114.6	K231 E246	K231-G242 PolarHBondContact NZ-O 2.87Å; G242-E246 VanDerWaalsContact CA-CD 3.42Å; G242-E246 WeakPolarHBondContact CA-OE1 3.45Å; G242-E246 WeakPolarHBondContact CA-OE2 3.48Å
243	G	95.4	Very high	92.4	Very high	26 Å²	26	50.6 Å²	50.6	27%	0.268	25%	0.254	S	S	.	.			trans	-76	175.7	172.5	0	0	0	0	0	113.4	Q245 E246 I247	G243-Q245 VanDerWaalsContact C-N 3.29Å; G243-Q245 PolarHBondContact O-N 2.83Å; G243-E246 PolarHBondContact N-OE1 2.75Å; G243-E246 PolarHBondContact O-N 3.5Å; G243-E246 VanDerWaalsContact O-N 3.09Å; G243-I247 WeakPolarHBondContact O-CD1 2.81Å; G243-I247 WeakPolarHBondContact O-CG1 3.3Å; G243-I247 PolarHBondContact O-N 3.29Å
244	L	97.2	Very high	92.5	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.068	29%	0.292	C	S	.	.	H	α-helix	trans	-51.8	-46	-175.4	177.4	61.6	0	0	0	112.6	F191 I247 A248 D265 L268 T269	F191-L244 HydrophobicContact CB-CD1 4.4Å; F191-L244 HydrophobicContact CD1-CB 3.85Å; F191-L244 HydrophobicContact CD2-CB 4.45Å; F191-L244 HydrophobicContact CD2-CD1 4.04Å; F191-L244 HydrophobicContact CE1-CB 3.84Å; F191-L244 HydrophobicContact CE2-CB 4.47Å; F191-L244 HydrophobicContact CG-CB 4.16Å; F191-L244 HydrophobicContact CG-CD1 4.11Å; F191-L244 HydrophobicContact CZ-CB 4.15Å; F191-L244 VanDerWaalsContact CZ-N 3.32Å; L244-I247 PolarHBondContact O-N 3.39Å; L244-A248 WeakPolarHBondContact O-CB 3.33Å; L244-A248 PolarHBondContact O-N 2.86Å; L244-D265 HydrophobicContact CD2-CB 4.16Å; L244-L268 HydrophobicContact CD2-CB 4.38Å; L244-L268 HydrophobicContact CD2-CD2 4.35Å; L244-L268 HydrophobicContact CG-CD2 4.08Å; L244-L268 HydrophobicContact CG-CG 4.31Å; L244-T269 VanDerWaalsContact CD2-OG1 3.3Å; L244-T269 WeakPolarHBondContact CD2-OG1 3.05Å
245	Q	97	Very high	92.7	Very high	39 Å²	39	60.3 Å²	60.3	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-62.5	-45.6	178.7	-171.5	60.7	54.5	0	0	112.5	G243 I247 A248 D249 R255	G243-Q245 VanDerWaalsContact C-N 3.29Å; G243-Q245 PolarHBondContact O-N 2.83Å; Q245-I247 VanDerWaalsContact C-N 3.26Å; Q245-I247 PolarHBondContact O-N 2.94Å; Q245-A248 WeakPolarHBondContact O-CB 3.43Å; Q245-A248 PolarHBondContact O-N 3.44Å; Q245-D249 PolarHBondContact NE2-OD1 3.47Å; Q245-D249 PolarHBondContact O-N 3.43Å; Q245-R255 VanDerWaalsContact OE1-NH2 3.16Å
246	E	96.2	Very high	93.1	Very high	109 Å²	109	58.2 Å²	58.2	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-38.3	-179.6	-65.3	166.4	-109.2	0	0	111.5	G242 G243 D249 I250	G242-E246 VanDerWaalsContact CA-CD 3.42Å; G242-E246 WeakPolarHBondContact CA-OE1 3.45Å; G242-E246 WeakPolarHBondContact CA-OE2 3.48Å; G243-E246 PolarHBondContact N-OE1 2.75Å; G243-E246 PolarHBondContact O-N 3.5Å; G243-E246 VanDerWaalsContact O-N 3.09Å; E246-D249 PolarHBondContact O-N 2.96Å; E246-I250 WeakPolarHBondContact O-CD1 3.28Å; E246-I250 WeakPolarHBondContact O-CG1 3.35Å; E246-I250 PolarHBondContact O-N 3.42Å
247	I	95.2	Very high	93.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-74.4	-39.7	179.6	-54.9	145.4	0	0	0	110.6	F191 M234 L240 G243 L244 Q245 D249 I250 L251 T272	F191-I247 HydrophobicContact CD2-CD1 4.47Å; F191-I247 HydrophobicContact CE2-CD1 3.3Å; F191-I247 HydrophobicContact CZ-CD1 3.52Å; M234-I247 HydrophobicContact CE-CD1 3.44Å; M234-I247 VanDerWaalsContact CE-CD1 3.44Å; M234-I247 HydrophobicContact CE-CG1 3.64Å; M234-I247 HydrophobicContact SD-CD1 3.21Å; M234-I247 WeakPolarHBondContact SD-CD1 3.39Å; M234-I247 HydrophobicContact SD-CG1 3.95Å; L240-I247 HydrophobicContact CD1-CG2 4.32Å; G243-I247 WeakPolarHBondContact O-CD1 2.81Å; G243-I247 WeakPolarHBondContact O-CG1 3.3Å; G243-I247 PolarHBondContact O-N 3.29Å; L244-I247 PolarHBondContact O-N 3.39Å; Q245-I247 VanDerWaalsContact C-N 3.26Å; Q245-I247 PolarHBondContact O-N 2.94Å; I247-D249 VanDerWaalsContact C-N 3.3Å; I247-D249 PolarHBondContact O-N 2.68Å; I247-I250 PolarHBondContact O-N 3.07Å; I247-L251 HydrophobicContact CG2-CD1 3.84Å; I247-L251 HydrophobicContact CG2-CG 4.2Å; I247-L251 WeakPolarHBondContact O-CB 3.45Å; I247-L251 VanDerWaalsContact O-CG 3.3Å; I247-L251 WeakPolarHBondContact O-CG 3.18Å; I247-L251 PolarHBondContact O-N 3.4Å; I247-T272 HydrophobicContact CB-CG2 4.44Å; I247-T272 HydrophobicContact CG2-CG2 3.86Å
248	A	97	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-44.7	172.5	0	0	0	0	0	111	L244 Q245 L251 Q252 V253 L268	L244-A248 WeakPolarHBondContact O-CB 3.33Å; L244-A248 PolarHBondContact O-N 2.86Å; Q245-A248 WeakPolarHBondContact O-CB 3.43Å; Q245-A248 PolarHBondContact O-N 3.44Å; A248-L251 CarbonylContact O-C 3.57Å; A248-L251 PolarHBondContact O-N 3.07Å; A248-Q252 PolarHBondContact O-N 3.47Å; A248-V253 HydrophobicContact CB-CB 4.17Å; A248-V253 PolarHBondContact O-N 2.76Å; A248-L268 HydrophobicContact CB-CD1 3.65Å; A248-L268 HydrophobicContact CB-CD2 3.91Å; A248-L268 HydrophobicContact CB-CG 3.94Å
249	D	96.5	Very high	94.6	Very high	100 Å²	100	60.2 Å²	60.2	54%	0.535	30%	0.303	S	S	.	.	H	α-helix	trans	-61.7	-45.9	176.3	-62.4	-18.8	0	0	0	111.4	Q245 E246 I247 L251 Q252	Q245-D249 PolarHBondContact NE2-OD1 3.47Å; Q245-D249 PolarHBondContact O-N 3.43Å; E246-D249 PolarHBondContact O-N 2.96Å; I247-D249 VanDerWaalsContact C-N 3.3Å; I247-D249 PolarHBondContact O-N 2.68Å; D249-L251 VanDerWaalsContact C-N 3.34Å; D249-L251 PolarHBondContact O-N 2.83Å; D249-Q252 PolarHBondContact O-N 3.43Å
250	I	94.8	Very high	95.4	Very high	93 Å²	93	59.6 Å²	59.6	48%	0.477	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-40.8	176.2	-70.3	162.5	0	0	0	111.8	L240 E246 I247 Q252	L240-I250 HydrophobicContact CD2-CG2 3.64Å; E246-I250 WeakPolarHBondContact O-CD1 3.28Å; E246-I250 WeakPolarHBondContact O-CG1 3.35Å; E246-I250 PolarHBondContact O-N 3.42Å; I247-I250 PolarHBondContact O-N 3.07Å; I250-Q252 VanDerWaalsContact C-N 3.3Å
251	L	95.3	Very high	95.9	Very high	6 Å²	6	59.6 Å²	59.6	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-85.5	-0	-178.8	-64.4	-177.2	0	0	0	113.7	L240 I247 A248 D249 V253 T272 R275 M276 L279	L240-L251 HydrophobicContact CD1-CD1 4.33Å; L240-L251 HydrophobicContact CD1-CD2 4.3Å; L240-L251 HydrophobicContact CD2-CD2 3.99Å; L240-L251 HydrophobicContact CD2-CG 4.39Å; I247-L251 HydrophobicContact CG2-CD1 3.84Å; I247-L251 HydrophobicContact CG2-CG 4.2Å; I247-L251 WeakPolarHBondContact O-CB 3.45Å; I247-L251 VanDerWaalsContact O-CG 3.3Å; I247-L251 WeakPolarHBondContact O-CG 3.18Å; I247-L251 PolarHBondContact O-N 3.4Å; A248-L251 CarbonylContact O-C 3.57Å; A248-L251 PolarHBondContact O-N 3.07Å; D249-L251 VanDerWaalsContact C-N 3.34Å; D249-L251 PolarHBondContact O-N 2.83Å; L251-V253 HydrophobicContact CB-CG2 4.11Å; L251-T272 HydrophobicContact CD1-CG2 4.02Å; L251-R275 HydrophobicContact CB-CG 3.94Å; L251-R275 WeakPolarHBondContact O-CG 3.39Å; L251-R275 PolarHBondContact O-NE 3.49Å; L251-M276 HydrophobicContact CD1-CB 3.79Å; L251-M276 HydrophobicContact CD1-CG 4.43Å; L251-L279 HydrophobicContact CD2-CD1 4.07Å
252	Q	96.8	Very high	96.3	Very high	171 Å²	171	51 Å²	51	80%	0.799	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	43.5	-178.7	-56.1	177.8	-12.2	0	0	113.3	A248 D249 I250	A248-Q252 PolarHBondContact O-N 3.47Å; D249-Q252 PolarHBondContact O-N 3.43Å; I250-Q252 VanDerWaalsContact C-N 3.3Å
253	V	97.4	Very high	96.5	Very high	20 Å²	20	50 Å²	50	12%	0.121	26%	0.255	C	S	.	.			trans	-101.1	114.9	177.1	-177.2	0	0	0	0	109.6	A248 L251 L268 A271 R275	A248-V253 HydrophobicContact CB-CB 4.17Å; A248-V253 PolarHBondContact O-N 2.76Å; L251-V253 HydrophobicContact CB-CG2 4.11Å; V253-L268 HydrophobicContact CB-CD1 4.48Å; V253-L268 HydrophobicContact CG1-CD1 3.8Å; V253-A271 HydrophobicContact CG1-CB 3.51Å; V253-R275 HydrophobicContact CG2-CB 3.75Å; V253-R275 HydrophobicContact CG2-CG 3.86Å
254	E	96.9	Very high	96.6	Very high	172 Å²	172	48.7 Å²	48.7	80%	0.804	24%	0.242	S	C	*	.			trans	-73	132.2	178.3	-172.3	-179.8	178.5	0	0	111.5
255	R	97.9	Very high	96.7	Very high	40 Å²	40	48.6 Å²	48.6	15%	0.151	24%	0.241	C	C	.	.			trans	-72.3	134.3	171.6	175.8	177.1	-72.2	-89.7	10.6	111	Q245 S264 D265 L268	Q245-R255 VanDerWaalsContact OE1-NH2 3.16Å; R255-S264 WeakPolarHBondContact CG-OG 3.35Å; R255-S264 PolarHBondContact NH1-OG 3.45Å; R255-D265 IonicContact CZ-OD1 2.61Å; R255-D265 IonicContact CZ-OD2 3.02Å; R255-D265 VanDerWaalsContact NH1-CG 3.25Å; R255-D265 IonicContact NH1-OD1 2.8Å; R255-D265 PolarHBondContact NH1-OD1 2.86Å; R255-D265 IonicContact NH1-OD2 3.47Å; R255-D265 PolarHBondContact NH1-OD2 2.93Å; R255-D265 IonicContact NH2-OD1 3.48Å; R255-D265 PolarHBondContact NH2-OD1 3.01Å; R255-D265 IonicContact NH2-OD2 3.56Å; R255-D265 PolarHBondContact NH2-OD2 2.89Å; R255-L268 HydrophobicContact CB-CD1 4.38Å; R255-L268 HydrophobicContact CB-CD2 4.43Å; R255-L268 VanDerWaalsContact NH2-CD2 3.32Å
256	I	96.4	Very high	96.8	Very high	50 Å²	50	46.7 Å²	46.7	26%	0.256	23%	0.233	S	C	.	.			trans	-113.7	124.9	170.5	-62.7	173.7	0	0	0	107.9	M45 I47 S264 L267	M45-I256 HydrophobicContact CB-CG2 3.72Å; M45-I256 HydrophobicContact CG-CG2 4.5Å; I47-I256 HydrophobicContact CD1-CG2 4.49Å; I256-S264 WeakPolarHBondContact O-CB 3.34Å; I256-S264 PolarHBondContact O-OG 3.12Å; I256-L267 HydrophobicContact CB-CD2 3.73Å; I256-L267 HydrophobicContact CD1-CD2 4.49Å; I256-L267 HydrophobicContact CG2-CD2 3.85Å
257	G	95.6	Very high	96.9	Very high	20 Å²	20	41.9 Å²	41.9	21%	0.206	21%	0.21	C	C	.	.	S	Bend	trans	92	-179.5	-174.8	0	0	0	0	0	114.3	S264	G257-S264 VanDerWaalsContact C-OG 3.27Å; G257-S264 PolarHBondContact O-OG 3.47Å
258	P	95.1	Very high	97.1	Very high	30 Å²	30	42 Å²	42	20%	0.195	21%	0.211	C	C	.	.			trans	-77.7	134.2	-177.5	31.8	-34.2	0	0	0	111.5	Y42 Q261 S264	Y42-P258 HydrophobicContact CE1-CG 3.96Å; P258-Q261 HydrophobicContact CB-CG 4.23Å; P258-Q261 HydrophobicContact CG-CB 4.02Å; P258-Q261 VanDerWaalsContact CG-CD 3.43Å; P258-Q261 HydrophobicContact CG-CG 3.7Å; P258-S264 WeakPolarHBondContact O-CB 3.34Å; P258-S264 PolarHBondContact O-OG 3.4Å
259	Q	95.7	Very high	97.2	Very high	88 Å²	88	42 Å²	42	41%	0.411	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	142.7	174	179.7	175.2	6.7	0	0	111.4	S154	S154-Q259 WeakPolarHBondContact CB-O 3.48Å
260	H	95.8	Very high	97.3	Very high	67 Å²	67	37.2 Å²	37.2	31%	0.31	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	46.6	-174.2	-58	-62.7	0	0	0	112	E77 S154 D265	E77-H260 WeakPolarHBondContact OE1-CA 3.09Å; S154-H260 VanDerWaalsContact CB-O 3.24Å; S154-H260 WeakPolarHBondContact CB-O 3.47Å; S154-H260 WeakPolarHBondContact OG-CB 3.25Å; H260-D265 PolarHBondContact N-OD1 2.9Å
261	Q	98	Very high	97.4	Very high	5 Å²	5	34.4 Å²	34.4	2%	0.023	18%	0.176	C	C	.	.	S	Bend	trans	-134.9	135.5	153.1	-57.2	-164.4	11.2	0	0	108.1	E77 S154 G155 I156 P258 G263 S264 D265	E77-Q261 PolarHBondContact OE1-N 2.84Å; S154-Q261 PolarHBondContact O-NE2 3.09Å; G155-Q261 PolarHBondContact O-NE2 2.82Å; I156-Q261 HydrophobicContact CD1-CG 3.84Å; P258-Q261 HydrophobicContact CB-CG 4.23Å; P258-Q261 HydrophobicContact CG-CB 4.02Å; P258-Q261 VanDerWaalsContact CG-CD 3.43Å; P258-Q261 HydrophobicContact CG-CG 3.7Å; Q261-G263 PolarHBondContact O-N 3.27Å; Q261-S264 PolarHBondContact O-N 2.9Å; Q261-D265 PolarHBondContact O-N 3.46Å; Q261-D265 VanDerWaalsContact O-N 3.09Å
262	A	98.4	Very high	97.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.5	-30.3	-166.9	0	0	0	0	0	113.6	E77 Q111 G113 S266	E77-A262 HydrophobicContact CG-CB 4.14Å; Q111-A262 HydrophobicContact CB-CB 3.79Å; Q111-A262 VanDerWaalsContact OE1-N 3.14Å; G113-A262 WeakPolarHBondContact CA-O 3.47Å; G113-A262 VanDerWaalsContact N-CB 3.26Å; A262-S266 WeakPolarHBondContact O-CB 3.48Å; A262-S266 PolarHBondContact O-N 3.02Å; A262-S266 PolarHBondContact O-OG 2.86Å
263	G	98.3	Very high	97.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-47.9	174.4	0	0	0	0	0	112.8	T129 Q261 S266 L267	T129-G263 WeakPolarHBondContact CG2-O 3.35Å; Q261-G263 PolarHBondContact O-N 3.27Å; G263-S266 PolarHBondContact O-OG 2.88Å; G263-L267 WeakPolarHBondContact O-CB 3.35Å; G263-L267 PolarHBondContact O-N 3.04Å
264	S	98.3	Very high	97.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.3	-42.4	178.1	-170.9	0	0	0	0	111.8	R255 I256 G257 P258 Q261 L267 L268	R255-S264 WeakPolarHBondContact CG-OG 3.35Å; R255-S264 PolarHBondContact NH1-OG 3.45Å; I256-S264 WeakPolarHBondContact O-CB 3.34Å; I256-S264 PolarHBondContact O-OG 3.12Å; G257-S264 VanDerWaalsContact C-OG 3.27Å; G257-S264 PolarHBondContact O-OG 3.47Å; P258-S264 WeakPolarHBondContact O-CB 3.34Å; P258-S264 PolarHBondContact O-OG 3.4Å; Q261-S264 PolarHBondContact O-N 2.9Å; S264-L267 PolarHBondContact O-N 2.84Å; S264-L268 WeakPolarHBondContact O-CB 3.38Å; S264-L268 PolarHBondContact O-N 2.83Å
265	D	98.6	Very high	97.7	Very high	10 Å²	10	21.9 Å²	21.9	5%	0.053	11%	0.112	C	C	.	.	H	α-helix	trans	-72.4	-34.2	-176.7	-75.8	68.1	0	0	0	111.9	D75 L244 R255 H260 Q261 L268 T269	D75-D265 HydrophobicContact CB-CB 4.21Å; D75-D265 VanDerWaalsContact OD2-CB 3.31Å; D75-D265 WeakPolarHBondContact OD2-CB 3.37Å; L244-D265 HydrophobicContact CD2-CB 4.16Å; R255-D265 IonicContact CZ-OD1 2.61Å; R255-D265 IonicContact CZ-OD2 3.02Å; R255-D265 VanDerWaalsContact NH1-CG 3.25Å; R255-D265 IonicContact NH1-OD1 2.8Å; R255-D265 PolarHBondContact NH1-OD1 2.86Å; R255-D265 IonicContact NH1-OD2 3.47Å; R255-D265 PolarHBondContact NH1-OD2 2.93Å; R255-D265 IonicContact NH2-OD1 3.48Å; R255-D265 PolarHBondContact NH2-OD1 3.01Å; R255-D265 IonicContact NH2-OD2 3.56Å; R255-D265 PolarHBondContact NH2-OD2 2.89Å; H260-D265 PolarHBondContact N-OD1 2.9Å; Q261-D265 PolarHBondContact O-N 3.46Å; Q261-D265 VanDerWaalsContact O-N 3.09Å; D265-L268 PolarHBondContact O-N 2.98Å; D265-T269 VanDerWaalsContact O-CB 3.27Å; D265-T269 WeakPolarHBondContact O-CB 3.44Å; D265-T269 PolarHBondContact O-N 3.32Å; D265-T269 PolarHBondContact O-OG1 3.11Å
266	S	98.8	Very high	97.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.7	-39.9	168.8	67.7	0	0	0	0	112.5	A73 G113 S115 A262 G263 T269 G270	A73-S266 WeakPolarHBondContact CB-O 3.43Å; G113-S266 WeakPolarHBondContact O-CB 3.45Å; S115-S266 PolarHBondContact OG-OG 3.02Å; A262-S266 WeakPolarHBondContact O-CB 3.48Å; A262-S266 PolarHBondContact O-N 3.02Å; A262-S266 PolarHBondContact O-OG 2.86Å; G263-S266 PolarHBondContact O-OG 2.88Å; S266-T269 WeakPolarHBondContact O-CB 3.33Å; S266-T269 PolarHBondContact O-N 3.5Å; S266-G270 PolarHBondContact O-N 3.25Å
267	L	98.5	Very high	97.6	Very high	7 Å²	7	20 Å²	20	4%	0.037	10%	0.103	C	C	.	.	H	α-helix	trans	-66.7	-42.5	177.9	177.4	54.8	0	0	0	111.2	I47 S115 F117 I256 G263 S264 G270 A271	I47-L267 HydrophobicContact CD1-CD2 4.25Å; I47-L267 HydrophobicContact CG1-CD2 4.27Å; S115-L267 VanDerWaalsContact OG-CA 3.24Å; S115-L267 WeakPolarHBondContact OG-CA 3.34Å; S115-L267 WeakPolarHBondContact OG-CB 3.17Å; S115-L267 PolarHBondContact OG-N 2.74Å; S115-L267 VanDerWaalsContact OG-N 3.11Å; F117-L267 HydrophobicContact CZ-CD1 4.01Å; I256-L267 HydrophobicContact CB-CD2 3.73Å; I256-L267 HydrophobicContact CD1-CD2 4.49Å; I256-L267 HydrophobicContact CG2-CD2 3.85Å; G263-L267 WeakPolarHBondContact O-CB 3.35Å; G263-L267 PolarHBondContact O-N 3.04Å; S264-L267 PolarHBondContact O-N 2.84Å; L267-G270 PolarHBondContact O-N 2.8Å; L267-A271 WeakPolarHBondContact O-CB 3.28Å; L267-A271 PolarHBondContact O-N 3.5Å; L267-A271 VanDerWaalsContact O-N 3.07Å
268	L	98.7	Very high	97.5	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-65.3	-40.5	174.4	-169.7	61	0	0	0	111.7	L244 A248 V253 R255 S264 D265 G270 A271 T272	L244-L268 HydrophobicContact CD2-CB 4.38Å; L244-L268 HydrophobicContact CD2-CD2 4.35Å; L244-L268 HydrophobicContact CG-CD2 4.08Å; L244-L268 HydrophobicContact CG-CG 4.31Å; A248-L268 HydrophobicContact CB-CD1 3.65Å; A248-L268 HydrophobicContact CB-CD2 3.91Å; A248-L268 HydrophobicContact CB-CG 3.94Å; V253-L268 HydrophobicContact CB-CD1 4.48Å; V253-L268 HydrophobicContact CG1-CD1 3.8Å; R255-L268 HydrophobicContact CB-CD1 4.38Å; R255-L268 HydrophobicContact CB-CD2 4.43Å; R255-L268 VanDerWaalsContact NH2-CD2 3.32Å; S264-L268 WeakPolarHBondContact O-CB 3.38Å; S264-L268 PolarHBondContact O-N 2.83Å; D265-L268 PolarHBondContact O-N 2.98Å; L268-G270 PolarHBondContact O-N 3.4Å; L268-A271 PolarHBondContact O-N 2.79Å; L268-T272 WeakPolarHBondContact O-CB 3.49Å; L268-T272 PolarHBondContact O-N 3.21Å; L268-T272 PolarHBondContact O-OG1 2.97Å
269	T	98.8	Very high	97.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58	-47.8	175.4	-69.3	0	0	0	0	111.6	A73 F191 V230 L244 D265 S266 T272 F273	A73-T269 HydrophobicContact CB-CG2 4.47Å; F191-T269 HydrophobicContact CB-CG2 4.18Å; V230-T269 HydrophobicContact CG2-CG2 4.42Å; L244-T269 VanDerWaalsContact CD2-OG1 3.3Å; L244-T269 WeakPolarHBondContact CD2-OG1 3.05Å; D265-T269 VanDerWaalsContact O-CB 3.27Å; D265-T269 WeakPolarHBondContact O-CB 3.44Å; D265-T269 PolarHBondContact O-N 3.32Å; D265-T269 PolarHBondContact O-OG1 3.11Å; S266-T269 WeakPolarHBondContact O-CB 3.33Å; S266-T269 PolarHBondContact O-N 3.5Å; T269-T272 PolarHBondContact O-N 3.38Å; T269-F273 WeakPolarHBondContact O-CB 3.39Å; T269-F273 PolarHBondContact O-N 2.84Å
270	G	98.7	Very high	97.3	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-48.1	176.9	0	0	0	0	0	112.8	A73 S266 L267 L268 T272 F273 F274	A73-G270 VanDerWaalsContact CB-CA 3.47Å; S266-G270 PolarHBondContact O-N 3.25Å; L267-G270 PolarHBondContact O-N 2.8Å; L268-G270 PolarHBondContact O-N 3.4Å; G270-T272 VanDerWaalsContact C-N 3.34Å; G270-T272 PolarHBondContact O-N 2.67Å; G270-F273 WeakPolarHBondContact O-CB 3.19Å; G270-F273 PolarHBondContact O-N 2.88Å; G270-F274 WeakPolarHBondContact O-CD2 3.42Å; G270-F274 PolarHBondContact O-N 2.72Å; G270-F274 VanDerWaalsContact O-N 3.09Å
271	A	98.4	Very high	97.2	Very high	33 Å²	33	19.4 Å²	19.4	27%	0.273	9%	0.094	S	C	.	.	H	α-helix	trans	-62	-41	178.2	0	0	0	0	0	112.4	V253 L267 L268 F274 R275	V253-A271 HydrophobicContact CG1-CB 3.51Å; L267-A271 WeakPolarHBondContact O-CB 3.28Å; L267-A271 PolarHBondContact O-N 3.5Å; L267-A271 VanDerWaalsContact O-N 3.07Å; L268-A271 PolarHBondContact O-N 2.79Å; A271-F274 PolarHBondContact O-N 2.66Å; A271-R275 WeakPolarHBondContact O-CB 3.45Å; A271-R275 PolarHBondContact O-N 3.17Å; A271-R275 VanDerWaalsContact O-N 3.07Å
272	T	98.2	Very high	96.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-43	175.5	-57.4	0	0	0	0	111.4	V230 I247 L251 L268 T269 G270 R275 M276	V230-T272 HydrophobicContact CG1-CG2 4.34Å; I247-T272 HydrophobicContact CB-CG2 4.44Å; I247-T272 HydrophobicContact CG2-CG2 3.86Å; L251-T272 HydrophobicContact CD1-CG2 4.02Å; L268-T272 WeakPolarHBondContact O-CB 3.49Å; L268-T272 PolarHBondContact O-N 3.21Å; L268-T272 PolarHBondContact O-OG1 2.97Å; T269-T272 PolarHBondContact O-N 3.38Å; G270-T272 VanDerWaalsContact C-N 3.34Å; G270-T272 PolarHBondContact O-N 2.67Å; T272-R275 PolarHBondContact O-N 3.17Å; T272-M276 WeakPolarHBondContact O-CB 3.04Å; T272-M276 PolarHBondContact O-N 3.47Å
273	F	98.3	Very high	96.6	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-57.5	-50.7	174.2	170.7	-94.8	0	0	0	112.1	L189 Y228 V230 L233 T269 G270 R275 M276 K277 I285	L189-F273 HydrophobicContact CD1-CB 3.92Å; L189-F273 HydrophobicContact CD1-CD1 3.35Å; L189-F273 HydrophobicContact CD1-CD2 4.48Å; L189-F273 HydrophobicContact CD1-CE1 3.95Å; L189-F273 HydrophobicContact CD1-CG 3.67Å; L189-F273 HydrophobicContact CD2-CD1 3.73Å; L189-F273 HydrophobicContact CD2-CD2 3.76Å; L189-F273 HydrophobicContact CD2-CE1 3.66Å; L189-F273 HydrophobicContact CD2-CE2 3.67Å; L189-F273 HydrophobicContact CD2-CG 3.78Å; L189-F273 HydrophobicContact CD2-CZ 3.62Å; L189-F273 HydrophobicContact CG-CD1 4.17Å; L189-F273 HydrophobicContact CG-CE1 4.46Å; L189-F273 HydrophobicContact CG-CG 4.24Å; Y228-F273 AromaticContact CD2-CE2 3.73Å; Y228-F273 HydrophobicContact CD2-CE2 3.73Å; Y228-F273 AromaticContact CD2-CZ 3.79Å; Y228-F273 HydrophobicContact CD2-CZ 3.79Å; Y228-F273 HydrophobicContact CE2-CZ 4.36Å; Y228-F273 HydrophobicContact CG-CE2 4.1Å; V230-F273 HydrophobicContact CG2-CB 3.71Å; V230-F273 HydrophobicContact CG2-CD2 4.04Å; V230-F273 HydrophobicContact CG2-CG 4.37Å; L233-F273 HydrophobicContact CD1-CD2 3.95Å; L233-F273 HydrophobicContact CD1-CE2 3.79Å; T269-F273 WeakPolarHBondContact O-CB 3.39Å; T269-F273 PolarHBondContact O-N 2.84Å; G270-F273 WeakPolarHBondContact O-CB 3.19Å; G270-F273 PolarHBondContact O-N 2.88Å; F273-R275 VanDerWaalsContact C-N 3.34Å; F273-R275 PolarHBondContact O-N 3.25Å; F273-M276 PolarHBondContact O-N 3.39Å; F273-K277 HydrophobicContact CE1-CD 3.98Å; F273-K277 HydrophobicContact CZ-CD 4.18Å; F273-K277 VanDerWaalsContact O-CB 3.25Å; F273-K277 WeakPolarHBondContact O-CB 3.25Å; F273-K277 PolarHBondContact O-N 3.37Å; F273-I285 HydrophobicContact CD2-CD1 4.4Å; F273-I285 HydrophobicContact CE2-CD1 3.47Å; F273-I285 VanDerWaalsContact CE2-CD1 3.47Å; F273-I285 HydrophobicContact CZ-CD1 3.69Å
274	F	98.1	Very high	96.4	Very high	30 Å²	30	34.2 Å²	34.2	13%	0.132	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-39.5	-177.7	-77.4	-70.1	0	0	0	112.1	V71 F117 T118 H119 L189 G270 A271 K277 E278	V71-F274 HydrophobicContact CB-CZ 4.39Å; V71-F274 HydrophobicContact CG1-CE2 4.3Å; V71-F274 HydrophobicContact CG1-CZ 3.97Å; V71-F274 HydrophobicContact CG2-CZ 4.49Å; F117-F274 HydrophobicContact CB-CE2 3.61Å; F117-F274 HydrophobicContact CB-CZ 4.03Å; F117-F274 HydrophobicContact CD1-CD2 4.11Å; F117-F274 AromaticContact CD1-CE2 3.88Å; F117-F274 HydrophobicContact CD1-CE2 3.88Å; F117-F274 HydrophobicContact CD2-CE2 4.28Å; F117-F274 HydrophobicContact CG-CD2 4.36Å; F117-F274 AromaticContact CG-CE2 3.69Å; F117-F274 HydrophobicContact CG-CE2 3.69Å; T118-F274 VanDerWaalsContact O-CZ 3.23Å; T118-F274 WeakPolarHBondContact O-CZ 3.43Å; H119-F274 WeakPolarHBondContact O-CE1 3.2Å; L189-F274 HydrophobicContact CD1-CE2 4.01Å; L189-F274 HydrophobicContact CD1-CZ 4.44Å; G270-F274 WeakPolarHBondContact O-CD2 3.42Å; G270-F274 PolarHBondContact O-N 2.72Å; G270-F274 VanDerWaalsContact O-N 3.09Å; A271-F274 PolarHBondContact O-N 2.66Å; F274-K277 PolarHBondContact O-N 3.3Å; F274-E278 PolarHBondContact O-N 3.31Å
275	R	96.8	Very high	96.2	Very high	75 Å²	75	34.6 Å²	34.6	28%	0.283	19%	0.185	S	C	.	.	H	α-helix	trans	-67.3	-39.7	175.9	-171.9	55.7	171.4	158.6	1.6	112.7	L251 V253 A271 T272 F273 E278 L279	L251-R275 HydrophobicContact CB-CG 3.94Å; L251-R275 WeakPolarHBondContact O-CG 3.39Å; L251-R275 PolarHBondContact O-NE 3.49Å; V253-R275 HydrophobicContact CG2-CB 3.75Å; V253-R275 HydrophobicContact CG2-CG 3.86Å; A271-R275 WeakPolarHBondContact O-CB 3.45Å; A271-R275 PolarHBondContact O-N 3.17Å; A271-R275 VanDerWaalsContact O-N 3.07Å; T272-R275 PolarHBondContact O-N 3.17Å; F273-R275 VanDerWaalsContact C-N 3.34Å; F273-R275 PolarHBondContact O-N 3.25Å; R275-E278 IonicContact CZ-OE2 3.92Å; R275-E278 VanDerWaalsContact NH1-CD 3.32Å; R275-E278 IonicContact NH1-OE1 2.72Å; R275-E278 IonicContact NH1-OE2 3.67Å; R275-E278 PolarHBondContact NH1-OE2 2.88Å; R275-E278 PolarHBondContact O-N 3.24Å; R275-L279 HydrophobicContact CG-CD1 4.2Å; R275-L279 WeakPolarHBondContact O-CB 3.22Å; R275-L279 WeakPolarHBondContact O-CG 3.37Å; R275-L279 PolarHBondContact O-N 3.38Å
276	M	95.9	Very high	95.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-41.8	174.5	-173.9	-177.8	61.3	0	0	111.5	V230 L233 M234 L240 L251 T272 F273 E278 L279 C280 F281	V230-M276 HydrophobicContact CB-CE 4.33Å; V230-M276 HydrophobicContact CG1-CE 3.84Å; V230-M276 HydrophobicContact CG1-SD 4.26Å; V230-M276 HydrophobicContact CG2-CE 4.36Å; L233-M276 HydrophobicContact CB-CE 3.5Å; L233-M276 HydrophobicContact CB-SD 4.33Å; L233-M276 HydrophobicContact CD1-CE 3.65Å; L233-M276 HydrophobicContact CG-CE 4.22Å; M234-M276 HydrophobicContact CG-SD 4.15Å; L240-M276 HydrophobicContact CD1-CG 4.03Å; L240-M276 HydrophobicContact CD1-SD 4.06Å; L251-M276 HydrophobicContact CD1-CB 3.79Å; L251-M276 HydrophobicContact CD1-CG 4.43Å; T272-M276 WeakPolarHBondContact O-CB 3.04Å; T272-M276 PolarHBondContact O-N 3.47Å; F273-M276 PolarHBondContact O-N 3.39Å; M276-E278 VanDerWaalsContact C-N 3.33Å; M276-E278 PolarHBondContact O-N 3.4Å; M276-L279 PolarHBondContact O-N 3.06Å; M276-C280 HydrophobicContact CG-CB 4.09Å; M276-C280 WeakPolarHBondContact O-CA 3.27Å; M276-C280 WeakPolarHBondContact O-CB 3.44Å; M276-C280 PolarHBondContact O-N 3.31Å; M276-F281 HydrophobicContact CE-CE2 4.21Å; M276-F281 HydrophobicContact CG-CD2 4.42Å; M276-F281 HydrophobicContact CG-CE2 4.02Å; M276-F281 HydrophobicContact SD-CE2 4.29Å
277	K	95.8	Very high	95.6	Very high	51 Å²	51	41 Å²	41	22%	0.222	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-43.2	175.3	174.4	179.6	170.3	-173.6	0	111.7	H119 F273 F274 F281 G283 I285	H119-K277 PolarHBondContact O-NZ 3.37Å; F273-K277 HydrophobicContact CE1-CD 3.98Å; F273-K277 HydrophobicContact CZ-CD 4.18Å; F273-K277 VanDerWaalsContact O-CB 3.25Å; F273-K277 WeakPolarHBondContact O-CB 3.25Å; F273-K277 PolarHBondContact O-N 3.37Å; F274-K277 PolarHBondContact O-N 3.3Å; K277-F281 CarbonylContact O-C 3.55Å; K277-F281 WeakPolarHBondContact O-CB 3.23Å; K277-F281 PolarHBondContact O-N 3.5Å; K277-G283 WeakPolarHBondContact CE-O 3.35Å; K277-G283 WeakPolarHBondContact O-CA 3.49Å; K277-G283 PolarHBondContact O-N 3.42Å; K277-I285 HydrophobicContact CB-CD1 3.93Å; K277-I285 HydrophobicContact CD-CD1 4.35Å; K277-I285 HydrophobicContact CG-CD1 4Å; K277-I285 HydrophobicContact CG-CG1 4.24Å
278	E	95.2	Very high	95.2	Very high	113 Å²	113	49.1 Å²	49.1	53%	0.528	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-53.6	175	-175.2	-168.9	-172.7	0	0	111.7	F274 R275 M276	F274-E278 PolarHBondContact O-N 3.31Å; R275-E278 IonicContact CZ-OE2 3.92Å; R275-E278 VanDerWaalsContact NH1-CD 3.32Å; R275-E278 IonicContact NH1-OE1 2.72Å; R275-E278 IonicContact NH1-OE2 3.67Å; R275-E278 PolarHBondContact NH1-OE2 2.88Å; R275-E278 PolarHBondContact O-N 3.24Å; M276-E278 VanDerWaalsContact C-N 3.33Å; M276-E278 PolarHBondContact O-N 3.4Å
279	L	93.4	Very high	94.9	Very high	61 Å²	61	52.2 Å²	52.2	32%	0.319	27%	0.272	S	S	.	.	H	α-helix	trans	-82	-34.7	-170	-68	179.7	0	0	0	115.1	L251 R275 M276 L309	L251-L279 HydrophobicContact CD2-CD1 4.07Å; R275-L279 HydrophobicContact CG-CD1 4.2Å; R275-L279 WeakPolarHBondContact O-CB 3.22Å; R275-L279 WeakPolarHBondContact O-CG 3.37Å; R275-L279 PolarHBondContact O-N 3.38Å; M276-L279 PolarHBondContact O-N 3.06Å; L279-L309 HydrophobicContact CB-CD2 4.02Å; L279-L309 VanDerWaalsContact O-CD2 3.28Å; L279-L309 WeakPolarHBondContact O-CD2 3.5Å
280	C	93	Very high	94.6	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.027	27%	0.273	C	S	.	.	H	α-helix	trans	-106.3	-10.2	-169.7	-52	0	0	0	0	113.7	T237 M276 V307 L309	T237-C280 HydrophobicContact CG2-CB 3.77Å; M276-C280 HydrophobicContact CG-CB 4.09Å; M276-C280 WeakPolarHBondContact O-CA 3.27Å; M276-C280 WeakPolarHBondContact O-CB 3.44Å; M276-C280 PolarHBondContact O-N 3.31Å; C280-V307 WeakPolarHBondContact O-CG1 3.37Å; C280-L309 HydrophobicContact CB-CD2 4.38Å; C280-L309 VanDerWaalsContact SG-CD2 3.55Å
281	F	93.2	Very high	94.5	Very high	14 Å²	14	53.9 Å²	53.9	6%	0.061	29%	0.285	C	S	.	.	S	Bend	trans	-136.5	14.3	-172.6	-63.1	-86.5	0	0	0	112.9	L233 A236 T237 M276 K277 G283 N284 I285 Y290	L233-F281 HydrophobicContact CB-CE2 4.39Å; L233-F281 HydrophobicContact CB-CZ 4.11Å; L233-F281 HydrophobicContact CD2-CE1 4.26Å; L233-F281 HydrophobicContact CD2-CE2 4.47Å; L233-F281 HydrophobicContact CD2-CZ 3.88Å; A236-F281 HydrophobicContact CB-CE1 4.36Å; A236-F281 HydrophobicContact CB-CZ 4.39Å; T237-F281 HydrophobicContact CG2-CE2 4.35Å; T237-F281 HydrophobicContact CG2-CZ 4.38Å; M276-F281 HydrophobicContact CE-CE2 4.21Å; M276-F281 HydrophobicContact CG-CD2 4.42Å; M276-F281 HydrophobicContact CG-CE2 4.02Å; M276-F281 HydrophobicContact SD-CE2 4.29Å; K277-F281 CarbonylContact O-C 3.55Å; K277-F281 WeakPolarHBondContact O-CB 3.23Å; K277-F281 PolarHBondContact O-N 3.5Å; F281-G283 PolarHBondContact O-N 2.83Å; F281-N284 CarbonylContact O-C 3.55Å; F281-N284 PolarHBondContact O-N 3.44Å; F281-N284 VanDerWaalsContact O-O 3.06Å; F281-I285 HydrophobicContact CB-CG1 3.85Å; F281-I285 HydrophobicContact CD1-CG1 4Å; F281-I285 HydrophobicContact CD2-CD1 4.29Å; F281-I285 HydrophobicContact CD2-CG1 4.05Å; F281-I285 HydrophobicContact CG-CD1 4.44Å; F281-I285 HydrophobicContact CG-CG1 3.71Å; F281-Y290 HydrophobicContact CD1-CE2 4.36Å; F281-Y290 AromaticContact CE1-CE2 3.82Å; F281-Y290 HydrophobicContact CE1-CE2 3.82Å; F281-Y290 AromaticContact CE1-CZ 3.75Å
282	D	92.3	Very high	94.3	Very high	152 Å²	152	53.7 Å²	53.7	81%	0.813	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	33.1	-177.7	-60.4	-41.2	0	0	0	113.6	N284	D282-N284 VanDerWaalsContact C-N 3.3Å; D282-N284 PolarHBondContact O-N 3.03Å
283	G	92.3	Very high	94.1	Very high	38 Å²	38	56.6 Å²	56.6	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-0.5	-176.3	0	0	0	0	0	115.7	K277 F281	K277-G283 WeakPolarHBondContact CE-O 3.35Å; K277-G283 WeakPolarHBondContact O-CA 3.49Å; K277-G283 PolarHBondContact O-N 3.42Å; F281-G283 PolarHBondContact O-N 2.83Å
284	N	92.4	Very high	94	Very high	125 Å²	125	56.6 Å²	56.6	67%	0.668	30%	0.297	S	S	*	.			trans	-131.5	110.8	-174	-172.2	39.9	0	0	0	113.3	F281 D282	F281-N284 CarbonylContact O-C 3.55Å; F281-N284 PolarHBondContact O-N 3.44Å; F281-N284 VanDerWaalsContact O-O 3.06Å; D282-N284 VanDerWaalsContact C-N 3.3Å; D282-N284 PolarHBondContact O-N 3.03Å
285	I	94.2	Very high	93.7	Very high	9 Å²	9	58.8 Å²	58.8	5%	0.046	31%	0.305	C	S	.	.			trans	-99.7	123.7	175.5	-65.9	169.6	0	0	0	108.4	Y228 L233 F273 K277 F281 P287 Y290	Y228-I285 HydrophobicContact CD1-CG2 4.26Å; Y228-I285 HydrophobicContact CE1-CG2 3.67Å; Y228-I285 HydrophobicContact CE2-CG2 4.31Å; L233-I285 HydrophobicContact CD1-CD1 4Å; L233-I285 HydrophobicContact CD2-CD1 4.37Å; L233-I285 HydrophobicContact CD2-CG2 3.8Å; F273-I285 HydrophobicContact CD2-CD1 4.4Å; F273-I285 HydrophobicContact CE2-CD1 3.47Å; F273-I285 VanDerWaalsContact CE2-CD1 3.47Å; F273-I285 HydrophobicContact CZ-CD1 3.69Å; K277-I285 HydrophobicContact CB-CD1 3.93Å; K277-I285 HydrophobicContact CD-CD1 4.35Å; K277-I285 HydrophobicContact CG-CD1 4Å; K277-I285 HydrophobicContact CG-CG1 4.24Å; F281-I285 HydrophobicContact CB-CG1 3.85Å; F281-I285 HydrophobicContact CD1-CG1 4Å; F281-I285 HydrophobicContact CD2-CD1 4.29Å; F281-I285 HydrophobicContact CD2-CG1 4.05Å; F281-I285 HydrophobicContact CG-CD1 4.44Å; F281-I285 HydrophobicContact CG-CG1 3.71Å; I285-P287 VanDerWaalsContact O-CD 3.25Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å; I285-Y290 HydrophobicContact CG2-CD2 3.64Å; I285-Y290 HydrophobicContact CG2-CE2 4.43Å; I285-Y290 HydrophobicContact CG2-CG 4.2Å
286	D	93	Very high	93.4	Very high	69 Å²	69	57.3 Å²	57.3	37%	0.369	31%	0.313	S	S	.	.			trans	-67.9	112.1	177.6	177.3	4.3	0	0	0	111.7	E288 R289 Y290	D286-E288 PolarHBondContact O-N 3.46Å; D286-E288 PolarHBondContact OD1-N 3.46Å; D286-R289 HydrophobicContact CB-CB 4.15Å; D286-R289 PolarHBondContact O-N 2.79Å; D286-R289 WeakPolarHBondContact OD2-CB 3.43Å; D286-Y290 HydrophobicContact CB-CD2 4.29Å; D286-Y290 HydrophobicContact CB-CE2 4.41Å; D286-Y290 VanDerWaalsContact O-CD2 3.26Å; D286-Y290 WeakPolarHBondContact O-CD2 3.46Å; D286-Y290 PolarHBondContact O-N 2.8Å
287	P	92.6	Very high	93	Very high	75 Å²	75	57.6 Å²	57.6	49%	0.487	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-34.9	-178.1	-19	32.8	0	0	0	113.3	Y228 I285 R289 Y290 A291	Y228-P287 WeakPolarHBondContact OH-CA 3.48Å; I285-P287 VanDerWaalsContact O-CD 3.25Å; I285-P287 WeakPolarHBondContact O-CD 3.38Å; P287-R289 PolarHBondContact O-N 2.8Å; P287-Y290 PolarHBondContact O-N 3.17Å; P287-A291 HydrophobicContact CB-CB 4.25Å; P287-A291 WeakPolarHBondContact O-CB 3.44Å; P287-A291 PolarHBondContact O-N 3.11Å
288	E	90.7	Very high	92.1	Very high	177 Å²	177	56 Å²	56	83%	0.827	31%	0.31	S	S	*	.	H	α-helix	trans	-63.8	-28.2	-177.9	-63.4	-169.3	172.2	0	0	111.7	D286	D286-E288 PolarHBondContact O-N 3.46Å; D286-E288 PolarHBondContact OD1-N 3.46Å
289	R	91.1	Very high	90.4	Very high	68 Å²	68	53.6 Å²	53.6	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-96.6	-25.9	-174.9	-177.7	171.1	154.8	-172.4	-14.4	114.4	D286 P287 Y293 A304 S305	D286-R289 HydrophobicContact CB-CB 4.15Å; D286-R289 PolarHBondContact O-N 2.79Å; D286-R289 WeakPolarHBondContact OD2-CB 3.43Å; P287-R289 PolarHBondContact O-N 2.8Å; R289-Y293 WeakPolarHBondContact O-CE2 3.06Å; R289-A304 PolarHBondContact NH2-O 3.45Å; R289-S305 VanDerWaalsContact CZ-N 3.3Å; R289-S305 PolarHBondContact NH1-O 3.2Å; R289-S305 PolarHBondContact NH2-O 2.98Å
290	Y	94.1	Very high	88.5	Confident	6 Å²	6	55.2 Å²	55.2	2%	0.024	32%	0.322	C	S	.	.	H	α-helix	trans	-128.3	-16.7	-171.5	-58.4	-67.2	0	0	0	115.8	L233 A236 F281 I285 D286 P287 A304	L233-Y290 HydrophobicContact CD2-CD1 3.72Å; L233-Y290 HydrophobicContact CD2-CD2 3.99Å; L233-Y290 HydrophobicContact CD2-CE1 4.26Å; L233-Y290 HydrophobicContact CD2-CG 3.53Å; A236-Y290 HydrophobicContact CB-CE1 3.86Å; A236-Y290 WeakPolarHBondContact CB-OH 3.43Å; F281-Y290 HydrophobicContact CD1-CE2 4.36Å; F281-Y290 AromaticContact CE1-CE2 3.82Å; F281-Y290 HydrophobicContact CE1-CE2 3.82Å; F281-Y290 AromaticContact CE1-CZ 3.75Å; I285-Y290 HydrophobicContact CG2-CD2 3.64Å; I285-Y290 HydrophobicContact CG2-CE2 4.43Å; I285-Y290 HydrophobicContact CG2-CG 4.2Å; D286-Y290 HydrophobicContact CB-CD2 4.29Å; D286-Y290 HydrophobicContact CB-CE2 4.41Å; D286-Y290 VanDerWaalsContact O-CD2 3.26Å; D286-Y290 WeakPolarHBondContact O-CD2 3.46Å; D286-Y290 PolarHBondContact O-N 2.8Å; P287-Y290 PolarHBondContact O-N 3.17Å; Y290-A304 HydrophobicContact CE1-CB 3.94Å
291	A	94.7	Very high	86.4	Confident	29 Å²	29	55.6 Å²	55.6	24%	0.24	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	137.1	-177.3	0	0	0	0	0	111.4	V227 Y228 P287 Y293	V227-A291 CarbonylContact O-C 3.58Å; V227-A291 WeakPolarHBondContact O-CA 3.37Å; Y228-A291 HydrophobicContact CD1-CB 4.43Å; Y228-A291 HydrophobicContact CE1-CB 3.79Å; P287-A291 HydrophobicContact CB-CB 4.25Å; P287-A291 WeakPolarHBondContact O-CB 3.44Å; P287-A291 PolarHBondContact O-N 3.11Å; A291-Y293 VanDerWaalsContact C-N 3.31Å; A291-Y293 PolarHBondContact O-N 3.37Å
292	G	94.8	Very high	84.2	Confident	29 Å²	29	63.4 Å²	63.4	30%	0.299	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	1.6	176.8	0	0	0	0	0	115.5	F217 V227	F217-G292 WeakPolarHBondContact CE1-O 3.49Å; V227-G292 PolarHBondContact O-N 3.24Å
293	Y	94.3	Very high	81.8	Confident	62 Å²	62	63.4 Å²	63.4	24%	0.243	36%	0.363	C	S	.	.			trans	-90.4	129.7	174.1	-61.1	-74.9	0	0	0	111.1	D229 R289 A291 S298	D229-Y293 WeakPolarHBondContact CB-O 3.4Å; R289-Y293 WeakPolarHBondContact O-CE2 3.06Å; A291-Y293 VanDerWaalsContact C-N 3.31Å; A291-Y293 PolarHBondContact O-N 3.37Å; Y293-S298 WeakPolarHBondContact CA-OG 3.35Å
294	L	95.4	Very high	79.5	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	35%	0.354	C	S	.	.			trans	-108.3	137.5	174.2	-55.7	-173.6	0	0	0	109.8	F197 F216 F217 L220 V227 D229 L297 S298	F197-L294 HydrophobicContact CB-CD1 4.19Å; F197-L294 HydrophobicContact CD2-CD1 3.85Å; F197-L294 HydrophobicContact CD2-CD2 3.74Å; F197-L294 HydrophobicContact CD2-CG 4.48Å; F197-L294 HydrophobicContact CE2-CD2 3.87Å; F197-L294 HydrophobicContact CG-CD1 4.39Å; F216-L294 HydrophobicContact CE1-CD1 4.05Å; F216-L294 HydrophobicContact CZ-CD1 4.37Å; F217-L294 HydrophobicContact CE1-CB 4.35Å; F217-L294 HydrophobicContact CE1-CD1 4.32Å; F217-L294 HydrophobicContact CE1-CG 3.94Å; F217-L294 HydrophobicContact CZ-CB 4.2Å; F217-L294 HydrophobicContact CZ-CD1 4.49Å; F217-L294 HydrophobicContact CZ-CG 4.24Å; L220-L294 HydrophobicContact CD2-CD1 3.88Å; L220-L294 HydrophobicContact CD2-CD2 4.48Å; L220-L294 HydrophobicContact CD2-CG 4.14Å; V227-L294 HydrophobicContact CG1-CD2 3.89Å; D229-L294 HydrophobicContact CB-CD2 4.34Å; L294-L297 HydrophobicContact CD1-CD1 4.44Å; L294-L297 PolarHBondContact O-N 3.2Å; L294-S298 PolarHBondContact N-OG 3.14Å; L294-S298 PolarHBondContact O-N 3.16Å; L294-S298 PolarHBondContact O-OG 2.92Å
295	Y	93.5	Very high	77.3	Confident	77 Å²	77	61 Å²	61	30%	0.302	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	138	179.6	-174.8	-84.6	0	0	0	111.2	H192 D229 K231 L297	H192-Y295 AromaticContact CD2-CD1 3.37Å; H192-Y295 WeakPolarHBondContact CD2-CD1 3.2Å; H192-Y295 AromaticContact NE2-CD1 3.51Å; H192-Y295 AromaticContact NE2-CE1 3.85Å; D229-Y295 VanDerWaalsContact OD2-CB 3.25Å; D229-Y295 WeakPolarHBondContact OD2-CB 3.26Å; D229-Y295 PolarHBondContact OD2-N 3.12Å; K231-Y295 HydrophobicContact CB-CD2 4.15Å; K231-Y295 HydrophobicContact CB-CG 4.08Å; K231-Y295 HydrophobicContact CG-CD1 3.91Å; K231-Y295 HydrophobicContact CG-CD2 3.42Å; K231-Y295 VanDerWaalsContact CG-CD2 3.42Å; K231-Y295 HydrophobicContact CG-CE1 4.22Å; K231-Y295 HydrophobicContact CG-CE2 3.78Å; K231-Y295 HydrophobicContact CG-CG 3.47Å; K231-Y295 VanDerWaalsContact CG-CG 3.47Å; Y295-L297 PolarHBondContact O-N 2.94Å
296	G	88.6	Confident	75.2	Confident	43 Å²	43	66.6 Å²	66.6	44%	0.443	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-21.4	178.1	0	0	0	0	0	115.6
297	L	87.4	Confident	73.4	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.037	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-54.6	179.9	-62.6	-179.2	0	0	0	113.1	A93 Q96 Y97 M100 E213 F216 F217 L294 Y295 S299	A93-L297 WeakPolarHBondContact CB-O 3.42Å; Q96-L297 HydrophobicContact CB-CD2 4.16Å; Y97-L297 HydrophobicContact CD2-CD2 4.43Å; M100-L297 HydrophobicContact CE-CD1 4.27Å; M100-L297 HydrophobicContact SD-CD1 3.72Å; E213-L297 VanDerWaalsContact CD-O 3.28Å; F216-L297 HydrophobicContact CE1-CD1 3.99Å; F217-L297 HydrophobicContact CE2-CB 4.05Å; F217-L297 HydrophobicContact CZ-CB 3.97Å; L294-L297 HydrophobicContact CD1-CD1 4.44Å; L294-L297 PolarHBondContact O-N 3.2Å; Y295-L297 PolarHBondContact O-N 2.94Å; L297-S299 PolarHBondContact O-N 2.91Å
298	S	77.7	Confident	71.3	Confident	18 Å²	18	66.1 Å²	66.1	13%	0.126	38%	0.375	C	S	.	.			trans	-65.8	106.5	-165	-56.3	0	0	0	0	114	F217 Y293 L294 S300 G301	F217-S298 WeakPolarHBondContact CE1-OG 3.46Å; F217-S298 WeakPolarHBondContact CZ-OG 3.35Å; Y293-S298 WeakPolarHBondContact CA-OG 3.35Å; L294-S298 PolarHBondContact N-OG 3.14Å; L294-S298 PolarHBondContact O-N 3.16Å; L294-S298 PolarHBondContact O-OG 2.92Å; S298-S300 PolarHBondContact O-N 3.03Å; S298-G301 PolarHBondContact O-N 3.05Å
299	S	60.7	Low	69.4	Low	62 Å²	62	59 Å²	59	43%	0.434	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26	179.8	-75	0	0	0	0	114.7	A93 E213 L297	A93-S299 WeakPolarHBondContact CB-OG 3.47Å; E213-S299 PolarHBondContact OE1-N 3.16Å; E213-S299 PolarHBondContact OE2-OG 3.14Å; L297-S299 PolarHBondContact O-N 2.91Å
300	S	53.4	Low	67	Low	94 Å²	94	61.2 Å²	61.2	66%	0.657	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-11.6	-173.5	-53.7	0	0	0	0	115.7	S298 Q302	S298-S300 PolarHBondContact O-N 3.03Å; S300-Q302 PolarHBondContact O-N 3.37Å
301	G	48.6	Very low	64.7	Low	12 Å²	12	64.5 Å²	64.5	12%	0.124	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-84.7	-1.1	-164.2	0	0	0	0	0	117.1	H232 S298 N303	H232-G301 PolarHBondContact CE1-O 3.27Å; S298-G301 PolarHBondContact O-N 3.05Å; G301-N303 VanDerWaalsContact C-N 3.33Å; G301-N303 PolarHBondContact O-N 3.22Å
302	Q	46.1	Very low	62.2	Low	178 Å²	178	67.6 Å²	67.6	83%	0.832	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-78	-6.7	-166.1	-64	-171.5	-1	0	0	115.8	S300	S300-Q302 PolarHBondContact O-N 3.37Å
303	N	41.2	Very low	59.2	Low	153 Å²	153	72 Å²	72	82%	0.818	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-100.2	22.8	-169.6	-69.1	-31	0	0	0	115.2	G301 S305	G301-N303 VanDerWaalsContact C-N 3.33Å; G301-N303 PolarHBondContact O-N 3.22Å; N303-S305 PolarHBondContact O-N 3.11Å
304	A	45.6	Very low	56.4	Low	24 Å²	24	75.2 Å²	75.2	20%	0.198	47%	0.47	C	S	.	.			trans	-75.2	103.7	-175.6	0	0	0	0	0	113.3	R289 Y290 E306	R289-A304 PolarHBondContact NH2-O 3.45Å; Y290-A304 HydrophobicContact CE1-CB 3.94Å; A304-E306 PolarHBondContact O-N 3.06Å
305	S	44.6	Very low	53.5	Low	87 Å²	87	80.3 Å²	80.3	61%	0.608	51%	0.505	S	S	*	.			trans	-49.2	112.3	178.2	-44.8	0	0	0	0	116.7	R289 N303	R289-S305 VanDerWaalsContact CZ-N 3.3Å; R289-S305 PolarHBondContact NH1-O 3.2Å; R289-S305 PolarHBondContact NH2-O 2.98Å; N303-S305 PolarHBondContact O-N 3.11Å
306	E	51.7	Low	50.8	Low	128 Å²	128	81.7 Å²	81.7	60%	0.598	53%	0.526	S	S	*	.			trans	-26.8	135.9	176.3	-106.2	177.7	178.4	0	0	118.9	K238 A304	K238-E306 WeakPolarHBondContact CE-OE1 3.17Å; K238-E306 WeakPolarHBondContact CE-OE2 3.48Å; K238-E306 HydrophobicContact CG-CG 4.21Å; K238-E306 IonicContact NZ-OE1 2.74Å; K238-E306 IonicContact NZ-OE2 3.15Å; K238-E306 PolarHBondContact NZ-OE2 3.45Å; A304-E306 PolarHBondContact O-N 3.06Å
307	V	55.3	Low	48.4	Very low	46 Å²	46	88.4 Å²	88.4	28%	0.279	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-118.1	143.4	165.2	-165.5	0	0	0	0	109.8	A236 C280	A236-V307 WeakPolarHBondContact O-CA 3.21Å; A236-V307 PolarHBondContact O-N 3.46Å; C280-V307 WeakPolarHBondContact O-CG1 3.37Å
308	V	48.4	Very low	45.9	Very low	88 Å²	88	96.2 Å²	96.2	53%	0.533	59%	0.588	S	S	.	*			trans	-114.5	124.2	-172.7	-172.2	0	0	0	0	110.4	K238 P310	K238-V308 HydrophobicContact CD-CG1 4.32Å; K238-V308 HydrophobicContact CD-CG2 3.86Å; V308-P310 WeakPolarHBondContact O-CD 3.49Å
309	L	49.8	Very low	43.7	Very low	27 Å²	27	98.3 Å²	98.3	14%	0.141	61%	0.613	C	S	.	*			trans	-68.1	123.7	173.6	-83.5	175.7	0	0	0	111.7	N239 L240 L279 C280	N239-L309 HydrophobicContact CB-CD1 4.34Å; L240-L309 HydrophobicContact CD2-CD1 4.44Å; L279-L309 HydrophobicContact CB-CD2 4.02Å; L279-L309 VanDerWaalsContact O-CD2 3.28Å; L279-L309 WeakPolarHBondContact O-CD2 3.5Å; C280-L309 HydrophobicContact CB-CD2 4.38Å; C280-L309 VanDerWaalsContact SG-CD2 3.55Å
310	P	40.7	Very low	42.3	Very low	115 Å²	115	101.8 Å²	101.8	75%	0.747	63%	0.631	S	S	*	*	S	Bend	trans	-77.3	123.9	166.7	30.7	-31	0	0	0	110.5	V308	V308-P310 WeakPolarHBondContact O-CD 3.49Å
311	G	46	Very low	41	Very low	74 Å²	74	104.1 Å²	104.1	76%	0.763	64%	0.642	S	S	*	*	S	Bend	trans	118.1	-8.7	160.9	0	0	0	0	0	118.3	S313	G311-S313 PolarHBondContact O-N 3.16Å
312	V	42.4	Very low	40.2	Very low	94 Å²	94	108.3 Å²	108.3	57%	0.57	67%	0.669	S	S	*	*			trans	-85.5	99.9	172.3	-177.4	0	0	0	0	109.6	T314	V312-T314 PolarHBondContact O-N 2.7Å
313	S	31.9	Very low	39.3	Very low	121 Å²	121	112 Å²	112	85%	0.846	68%	0.676	S	S	*	*			trans	-86.5	102.2	178.4	32.5	0	0	0	0	112	G311	G311-S313 PolarHBondContact O-N 3.16Å
314	T	35.3	Very low	38.8	Very low	131 Å²	131	113.4 Å²	113.4	80%	0.804	68%	0.677	S	S	*	*			trans	-108.8	120.8	161.7	51.4	0	0	0	0	109.8	V312	V312-T314 PolarHBondContact O-N 2.7Å
315	S	34.9	Very low	37.8	Very low	107 Å²	107	123.6 Å²	123.6	75%	0.748	71%	0.71	S	S	*	*			trans	-85.9	156.6	-178.5	50.2	0	0	0	0	113.1
316	S	37.1	Very low	37.1	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	72%	0.72	S	S	*	*			trans	65.7	148.5	163.1	66.3	0	0	0	0	117.6
317	E	36.9	Very low	36	Very low	185 Å²	185	129.6 Å²	129.6	86%	0.864	73%	0.728	S	S	*	*			cis	-164.2	153.2	-26.1	-120.8	170.4	176.4	0	0	107.5
318	D	36	Very low	34.7	Very low	170 Å²	170	134.3 Å²	134.3	91%	0.909	75%	0.752	S	S	*	*			trans	50.7	147.8	163.8	-102.3	-25.9	0	0	0	122.6
319	G	30.3	Very low	33.8	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	77%	0.765	S	S	*	*			trans	-99.9	154.1	-172.2	0	0	0	0	0	115
320	T	31.8	Very low	33.1	Very low	135 Å²	135	142.5 Å²	142.5	83%	0.828	79%	0.786	S	S	*	*			trans	-150.9	129.3	145.4	-68.6	0	0	0	0	108.7	S322	T320-S322 PolarHBondContact O-N 3.02Å
321	T	27.5	Very low	32.5	Very low	142 Å²	142	141.5 Å²	141.5	87%	0.871	79%	0.788	S	S	*	*			trans	-72.6	117.9	178.4	36.3	0	0	0	0	110.9
322	S	31.3	Very low	32	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	78%	0.782	S	S	*	*			trans	-152.2	129.7	168.4	-84	0	0	0	0	111.4	T320 Q324	T320-S322 PolarHBondContact O-N 3.02Å; S322-Q324 PolarHBondContact O-N 3.03Å; S322-Q324 VanDerWaalsContact O-N 3.09Å
323	R	27.3	Very low	31.3	Very low	255 Å²	255	144.4 Å²	144.4	96%	0.962	78%	0.784	S	S	*	*			trans	-62	108.7	179.6	-72.9	174	169	167.5	-5.2	109.9
324	Q	29.1	Very low	31.2	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	79%	0.786	S	S	*	*			trans	-107.9	111.1	166.9	-80.6	-172.2	-17.4	0	0	111.4	S322 M326	S322-Q324 PolarHBondContact O-N 3.03Å; S322-Q324 VanDerWaalsContact O-N 3.09Å; Q324-M326 PolarHBondContact O-N 2.97Å
325	R	26.5	Very low	30.9	Very low	237 Å²	237	146 Å²	146	89%	0.894	77%	0.774	S	S	*	*			trans	-40.6	113.7	162.8	175	-177.9	-179.8	-175.8	1	110.5	K327	R325-K327 PolarHBondContact O-N 2.93Å
326	M	27.9	Very low	30.8	Very low	164 Å²	164	150 Å²	150	81%	0.808	78%	0.781	S	S	*	*			trans	-56.8	123.6	166.3	-77.7	-178.4	164.4	0	0	108.4	Q324	Q324-M326 PolarHBondContact O-N 2.97Å
327	K	29	Very low	30.7	Very low	178 Å²	178	153.3 Å²	153.3	77%	0.774	78%	0.782	S	S	*	*			trans	-74.8	133.4	164.3	-74.4	177.1	173.9	178.4	0	106.8	R325 D329	R325-K327 PolarHBondContact O-N 2.93Å; K327-D329 PolarHBondContact O-N 3.43Å
328	N	29.7	Very low	31.3	Very low	145 Å²	145	152.2 Å²	152.2	78%	0.775	78%	0.776	S	S	*	*			trans	-69	115	163.2	-74.2	-3.5	0	0	0	107.2	F330	N328-F330 PolarHBondContact O-N 3.05Å
329	D	28.8	Very low	31.5	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	77%	0.765	S	S	*	*	S	Bend	trans	-77.6	60.9	168.3	-67.5	-37	0	0	0	109.9	K327	K327-D329 PolarHBondContact O-N 3.43Å
330	F	35.4	Very low	32.6	Very low	136 Å²	136	147.8 Å²	147.8	60%	0.596	76%	0.756	S	S	*	*			trans	-128.5	55.9	162.8	-103.7	-76.9	0	0	0	107.6	N328 H332	N328-F330 PolarHBondContact O-N 3.05Å; F330-H332 AromaticContact CD1-CD2 3.55Å; F330-H332 AromaticContact CD1-NE2 3.44Å; F330-H332 WeakPolarHBondContact CD1-NE2 3.39Å; F330-H332 AromaticContact CE1-CD2 3.94Å; F330-H332 AromaticContact CE1-NE2 3.37Å; F330-H332 WeakPolarHBondContact CE1-NE2 3.16Å; F330-H332 PolarHBondContact O-N 3.35Å
331	A	26.5	Very low	34	Very low	95 Å²	95	145.2 Å²	145.2	79%	0.785	74%	0.74	S	S	*	*			trans	-77.5	65.1	170.3	0	0	0	0	0	109.9
332	H	35.8	Very low	35	Very low	135 Å²	135	145.1 Å²	145.1	63%	0.625	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-71.5	131	167.4	-79.2	-46	0	0	0	109.6	F330 M334	F330-H332 AromaticContact CD1-CD2 3.55Å; F330-H332 AromaticContact CD1-NE2 3.44Å; F330-H332 WeakPolarHBondContact CD1-NE2 3.39Å; F330-H332 AromaticContact CE1-CD2 3.94Å; F330-H332 AromaticContact CE1-NE2 3.37Å; F330-H332 WeakPolarHBondContact CE1-NE2 3.16Å; F330-H332 PolarHBondContact O-N 3.35Å; H332-M334 PolarHBondContact O-N 3.42Å
333	P	28.6	Very low	36	Very low	94 Å²	94	141.6 Å²	141.6	61%	0.61	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65.9	122	172	27.9	-32.2	0	0	0	109.3	N335	P333-N335 PolarHBondContact O-N 2.94Å
334	M	29.5	Very low	36.9	Very low	183 Å²	183	132.3 Å²	132.3	90%	0.901	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.7	165.4	-70.8	-78.6	-172.1	0	0	108.2	H332	H332-M334 PolarHBondContact O-N 3.42Å
335	N	29.4	Very low	38.1	Very low	101 Å²	101	126 Å²	126	54%	0.54	65%	0.646	S	S	.	*			trans	-120.8	107.2	177.3	-164.3	4.2	0	0	0	109.7	P333 K337	P333-N335 PolarHBondContact O-N 2.94Å; N335-K337 PolarHBondContact O-N 2.54Å
336	E	32	Very low	39.2	Very low	192 Å²	192	121 Å²	121	90%	0.897	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	25.2	-161.7	-58	178.8	130.1	0	0	115.8
337	K	36.3	Very low	39.9	Very low	176 Å²	176	115.8 Å²	115.8	77%	0.765	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-15.9	-170.6	-74	-165.8	172.1	-175.4	0	117.5	N335	N335-K337 PolarHBondContact O-N 2.54Å
338	H	48.7	Very low	40.2	Very low	161 Å²	161	114.6 Å²	114.6	75%	0.745	62%	0.622	S	S	*	*	S	Bend	trans	-141.1	101.6	161.7	-68.7	90.6	0	0	0	106.5
339	G	41	Very low	40.5	Very low	65 Å²	65	114.1 Å²	114.1	67%	0.67	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-66.4	145.3	-169.6	0	0	0	0	0	112.7	V341	G339-V341 PolarHBondContact O-N 3.02Å
340	V	53.5	Low	40.8	Very low	75 Å²	75	115.9 Å²	115.9	46%	0.455	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-62.2	123.5	166.4	173.9	0	0	0	0	107.8	V82 R84	V82-V340 CarbonylContact O-C 3.57Å; V82-V340 VanDerWaalsContact O-CA 3.29Å; V82-V340 WeakPolarHBondContact O-CA 3.45Å; R84-V340 HydrophobicContact CB-CG1 4.26Å; R84-V340 HydrophobicContact CG-CG1 3.88Å
341	V	59.2	Low	40.9	Very low	81 Å²	81	114.9 Å²	114.9	49%	0.491	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.1	126	179	-175.3	0	0	0	0	109.2	V82 A83 R84 G339 L343	V82-V341 PolarHBondContact O-N 3.1Å; A83-V341 WeakPolarHBondContact CA-O 2.89Å; A83-V341 WeakPolarHBondContact CB-O 3.45Å; R84-V341 PolarHBondContact N-O 3.1Å; R84-V341 VanDerWaalsContact N-O 3.1Å; G339-V341 PolarHBondContact O-N 3.02Å; V341-L343 HydrophobicContact CG1-CD2 3.94Å; V341-L343 HydrophobicContact CG1-CG 4.11Å
342	E	49.8	Very low	41.2	Very low	141 Å²	141	114 Å²	114	66%	0.659	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.1	125.8	170	-93.6	179.2	-168.8	0	0	108.9	I86	I86-E342 HydrophobicContact CD1-CB 3.62Å; I86-E342 HydrophobicContact CD1-CG 4.24Å; I86-E342 HydrophobicContact CG1-CB 3.79Å; I86-E342 HydrophobicContact CG1-CG 3.96Å
343	L	52.9	Low	41.1	Very low	26 Å²	26	116.9 Å²	116.9	14%	0.136	65%	0.645	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.4	133.2	-179.3	-66.6	174	0	0	0	109.8	A83 R84 P85 I86 L106 V341 I349	A83-L343 HydrophobicContact CB-CD1 4.11Å; R84-L343 PolarHBondContact O-N 3.47Å; P85-L343 CarbonylContact C-O 3.58Å; P85-L343 WeakPolarHBondContact CA-O 3.25Å; I86-L343 PolarHBondContact N-O 2.86Å; L106-L343 HydrophobicContact CD1-CD1 3.76Å; L106-L343 HydrophobicContact CD2-CD1 4.22Å; L106-L343 HydrophobicContact CG-CD1 4.48Å; V341-L343 HydrophobicContact CG1-CD2 3.94Å; V341-L343 HydrophobicContact CG1-CG 4.11Å; L343-I349 HydrophobicContact CD2-CG1 4.35Å
344	D	45.6	Very low	41.4	Very low	61 Å²	61	122.6 Å²	122.6	33%	0.326	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.2	154	165.2	179.8	40.5	0	0	0	110.3	N346 G347	D344-N346 PolarHBondContact O-N 3.07Å; D344-N346 PolarHBondContact OD2-ND2 2.83Å; D344-G347 PolarHBondContact O-N 2.85Å
345	V	54.2	Low	41.4	Very low	51 Å²	51	120.9 Å²	120.9	31%	0.309	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58	-18	-174.7	-164	0	0	0	0	112.9	I86	I86-V345 WeakPolarHBondContact O-CG2 3.46Å
346	N	49.6	Very low	41.8	Very low	132 Å²	132	121.3 Å²	121.3	71%	0.706	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-5.7	-180	-52.6	-62.7	0	0	0	114.6	D344	D344-N346 PolarHBondContact O-N 3.07Å; D344-N346 PolarHBondContact OD2-ND2 2.83Å
347	G	43.4	Very low	41.9	Very low	53 Å²	53	116.9 Å²	116.9	55%	0.546	65%	0.654	S	S	.	*			trans	83.4	13.2	176.2	0	0	0	0	0	116.3	D344	D344-G347 PolarHBondContact O-N 2.85Å
348	E	34.7	Very low	41.8	Very low	153 Å²	153	114 Å²	114	72%	0.715	65%	0.651	S	S	*	*			trans	-85.1	140.7	170.3	-61.9	-166.3	156.8	0	0	111
349	I	36.3	Very low	41	Very low	136 Å²	136	114.7 Å²	114.7	70%	0.697	66%	0.659	S	S	*	*			trans	-95.3	107.1	-179.1	-58.5	175.2	0	0	0	109.2	L343 S351	L343-I349 HydrophobicContact CD2-CG1 4.35Å; I349-S351 PolarHBondContact O-N 3.1Å
350	E	34.4	Very low	40.6	Very low	187 Å²	187	114.4 Å²	114.4	87%	0.874	66%	0.656	S	S	*	*			trans	-76.8	101.1	168.2	-77.7	-157.1	137.6	0	0	111.3	G352	E350-G352 VanDerWaalsContact C-N 3.29Å; E350-G352 PolarHBondContact O-N 2.69Å
351	S	38.3	Very low	39.8	Very low	114 Å²	114	117 Å²	117	80%	0.797	67%	0.672	S	S	*	*			trans	-79.4	73.3	169.3	49.4	0	0	0	0	111.8	I349 Q353	I349-S351 PolarHBondContact O-N 3.1Å; S351-Q353 VanDerWaalsContact C-N 3.34Å; S351-Q353 PolarHBondContact O-N 2.92Å
352	G	31.4	Very low	38.5	Very low	78 Å²	78	120.2 Å²	120.2	80%	0.804	69%	0.686	S	S	*	*			trans	-73.1	66.5	-178.4	0	0	0	0	0	116.1	E350	E350-G352 VanDerWaalsContact C-N 3.29Å; E350-G352 PolarHBondContact O-N 2.69Å
353	Q	33.9	Very low	37.7	Very low	194 Å²	194	119.6 Å²	119.6	91%	0.907	69%	0.692	S	S	*	*			trans	-133.2	135.5	161.9	-103.5	-173	-21.1	0	0	113.5	S351	S351-Q353 VanDerWaalsContact C-N 3.34Å; S351-Q353 PolarHBondContact O-N 2.92Å
354	K	35.6	Very low	36.5	Very low	214 Å²	214	122.9 Å²	122.9	93%	0.93	72%	0.717	S	S	*	*			trans	-73.4	130.6	-168.6	-71.6	170.9	173.9	170.9	0	113.3
355	D	29.6	Very low	36	Very low	147 Å²	147	127.8 Å²	127.8	79%	0.786	74%	0.743	S	S	*	*			trans	-49.2	164.1	153.4	-116.2	-22.8	0	0	0	112.6
356	P	37.2	Very low	34.7	Very low	110 Å²	110	132.3 Å²	132.3	71%	0.714	77%	0.765	S	S	*	*			cis	-144.4	166.4	41	39.5	-19.2	0	0	0	120
357	S	33.9	Very low	33.9	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	77%	0.772	S	S	*	*			trans	80.6	135.8	157.6	78.1	0	0	0	0	116
358	V	34.8	Very low	33.2	Very low	115 Å²	115	132.9 Å²	132.9	70%	0.697	78%	0.783	S	S	*	*			cis	-158.7	139.9	44.3	166.5	0	0	0	0	112.1
359	L	32.3	Very low	33.1	Very low	176 Å²	176	134 Å²	134	92%	0.921	79%	0.793	S	S	*	*			trans	57.8	134	161.3	-67.5	162.1	0	0	0	119.7
360	G	32.6	Very low	32.7	Very low	58 Å²	58	131.9 Å²	131.9	60%	0.598	79%	0.79	S	S	*	*			cis	170.9	166.3	-5.8	0	0	0	0	0	113.8
361	T	35.1	Very low	32.6	Very low	130 Å²	130	130 Å²	130	80%	0.798	79%	0.791	S	S	*	*			trans	60.4	108.8	167	52.3	0	0	0	0	118
362	D	32.4	Very low	32.4	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	79%	0.786	S	S	*	*				77.2	134.7	80.5	-74	-36.6	0	0	0	113
363	V	34.4	Very low	32.5	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	79%	0.792	S	S	*	*			cis	-154.3	154.5	13.1	124.1	0	0	0	0	110.3
364	S	27.8	Very low	32.4	Very low	96 Å²	96	128 Å²	128	67%	0.671	79%	0.787	S	S	*	*			trans	-84.3	156.2	174	176.7	0	0	0	0	112.5
365	L	33.2	Very low	32.4	Very low	164 Å²	164	124.3 Å²	124.3	86%	0.859	78%	0.778	S	S	*	*			trans	-172.8	144	137.8	-103.5	162.7	0	0	0	114.6
366	N	27.8	Very low	32.7	Very low	145 Å²	145	124 Å²	124	78%	0.775	77%	0.772	S	S	*	*			trans	-77.7	155.3	175.8	-56.8	-58.4	0	0	0	112.7
367	A	33.2	Very low	32.6	Very low	103 Å²	103	126.9 Å²	126.9	85%	0.851	77%	0.773	S	S	*	*				-174	135.3	126.3	0	0	0	0	0	112
368	A	28.4	Very low	32.7	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	77%	0.772	S	S	*	*			trans	-90.9	147	157.1	0	0	0	0	0	109.2
369	L	31.7	Very low	32.8	Very low	177 Å²	177	130.9 Å²	130.9	93%	0.927	78%	0.777	S	S	*	*			trans	-170.8	164.1	143.2	-104.3	167.9	0	0	0	111.9
370	S	29.7	Very low	32.9	Very low	92 Å²	92	130.8 Å²	130.8	64%	0.643	77%	0.772	S	S	*	*			trans	-93.1	153.5	-154.9	54.6	0	0	0	0	117.6
371	V	32.1	Very low	33	Very low	146 Å²	146	137.1 Å²	137.1	89%	0.885	79%	0.786	S	S	*	*			trans	75.9	128	144.4	169.3	0	0	0	0	119.6
372	G	32.7	Very low	33	Very low	68 Å²	68	136 Å²	136	70%	0.701	78%	0.783	S	S	*	*			trans	157.8	92.8	152.8	0	0	0	0	0	117.7
373	H	33.6	Very low	33	Very low	199 Å²	199	134.8 Å²	134.8	92%	0.921	78%	0.781	S	S	*	*			trans	15.3	134.3	149.6	-73.2	73.9	0	0	0	121.3
374	G	33	Very low	32.8	Very low	79 Å²	79	132.9 Å²	132.9	81%	0.814	78%	0.779	S	S	*	*			trans	174.7	100.9	161.2	0	0	0	0	0	116.2
375	D	35.5	Very low	33	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	79%	0.792	S	S	*	*			trans	-48.3	146.7	177.8	-83.1	-87.7	0	0	0	120.6
376	Q	35.8	Very low	33	Very low	141 Å²	141	135.5 Å²	135.5	66%	0.659	79%	0.786	S	S	*	*			trans	75	121.9	132	-72.2	175.2	55.9	0	0	124.4
377	K	35.2	Very low	33	Very low	169 Å²	169	136 Å²	136	74%	0.735	78%	0.784	S	S	*	*				107.3	147.9	116.6	-91.6	-179.7	-179.5	177.5	0	123
378	N	35.7	Very low	32.8	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	79%	0.785	S	S	*	*			trans	81.1	124.4	169.1	-53.9	-5.2	0	0	0	115.5
379	E	36.4	Very low	33	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.794	79%	0.788	S	S	*	*				67	136.4	56.3	-63.5	173.6	177.1	0	0	111.8
380	E	33.7	Very low	33.1	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	79%	0.787	S	S	*	*			cis	-163.4	-171.6	-7.8	-114.7	-172.3	163	0	0	107.8
381	E	35.1	Very low	33.2	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	80%	0.795	S	S	*	*			trans	104.3	133	171.4	-59.1	-173.1	144.4	0	0	117.5
382	S	34.7	Very low	33.3	Very low	107 Å²	107	139 Å²	139	75%	0.748	79%	0.79	S	S	*	*			cis	95	134.6	13.6	-163.2	0	0	0	0	115.7
383	T	33.9	Very low	33.8	Very low	122 Å²	122	143.9 Å²	143.9	75%	0.748	80%	0.8	S	S	*	*			cis	-164.1	142.4	-15.9	-87.4	0	0	0	0	110.7
384	A	28.8	Very low	34	Very low	88 Å²	88	140.8 Å²	140.8	73%	0.727	80%	0.795	S	S	*	*			trans	61.7	142.3	159.6	0	0	0	0	0	122.5
385	V	32.1	Very low	34.6	Very low	154 Å²	154	144.2 Å²	144.2	93%	0.933	80%	0.795	S	S	*	*			trans	-142.3	138.1	145.2	-178.8	0	0	0	0	108.4
386	Q	33.2	Very low	34.9	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.752	80%	0.798	S	S	*	*			trans	-136.1	138.1	-179	-169.2	179.6	-13.2	0	0	110.1
387	E	29.4	Very low	35.2	Very low	156 Å²	156	143.8 Å²	143.8	73%	0.729	80%	0.799	S	S	*	*			trans	35.7	136.5	158.8	-64.5	172.3	124.3	0	0	122.4
388	I	28.9	Very low	35.8	Very low	168 Å²	168	140.7 Å²	140.7	86%	0.862	80%	0.799	S	S	*	*				166.4	127.4	124.7	-84.9	154.4	0	0	0	110.3
389	S	32.5	Very low	36.4	Very low	120 Å²	120	144 Å²	144	84%	0.839	81%	0.81	S	S	*	*			trans	-174.4	124	139.4	20.5	0	0	0	0	111.7
390	Q	33.6	Very low	37.1	Very low	194 Å²	194	139.3 Å²	139.3	91%	0.907	81%	0.808	S	S	*	*			trans	-142.2	152.1	165.5	-97.9	-165	2.5	0	0	110.1
391	A	32.2	Very low	37.8	Very low	99 Å²	99	136.7 Å²	136.7	82%	0.818	81%	0.806	S	S	*	*			trans	88.2	144.2	154.2	0	0	0	0	0	120.7
392	A	33.1	Very low	38.4	Very low	94 Å²	94	136 Å²	136	78%	0.777	80%	0.8	S	S	*	*			trans	79.2	103.3	162.8	0	0	0	0	0	118.8
393	D	43.9	Very low	39.1	Very low	171 Å²	171	139 Å²	139	91%	0.914	80%	0.802	S	S	*	*				-141.8	141.2	120.5	-113.5	-25.7	0	0	0	109.5
394	T	38	Very low	40.3	Very low	133 Å²	133	144.7 Å²	144.7	82%	0.816	83%	0.825	S	S	*	*			trans	-126.8	136	179.3	43.6	0	0	0	0	108.8
395	D	44.7	Very low	40.9	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	83%	0.83	S	S	*	*			trans	-148.9	159.5	158.9	-138.5	-13.8	0	0	0	114.5
396	E	41.5	Very low	41.3	Very low	171 Å²	171	147.2 Å²	147.2	80%	0.799	83%	0.825	S	S	*	*			trans	-37.2	164.3	177.6	-76.1	-178.3	169.3	0	0	118.8
397	S	42.8	Very low	41.8	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	83%	0.829	S	S	*	*			cis	-173.1	-174	-11.3	55.4	0	0	0	0	110.9
398	S	47.4	Very low	42.5	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	84%	0.835	S	S	*	*			trans	94.5	117.1	161.3	75.9	0	0	0	0	120.5
399	E	49.1	Very low	43.4	Very low	197 Å²	197	144.4 Å²	144.4	92%	0.921	83%	0.833	S	S	*	*			trans	35	135.8	135.2	-52.4	-175.4	154.2	0	0	121.1
400	G	50.3	Low	44.1	Very low	72 Å²	72	146.1 Å²	146.1	74%	0.742	83%	0.833	S	S	*	*			cis	-175.5	176.3	1.4	0	0	0	0	0	111.3
401	P	49.3	Very low	44.9	Very low	121 Å²	121	142.6 Å²	142.6	79%	0.786	83%	0.827	S	S	*	*			trans	-114.2	152.1	-164.2	39.1	-30.9	0	0	0	116.3
402	K	46.3	Very low	45.8	Very low	175 Å²	175	146 Å²	146	76%	0.761	83%	0.828	S	S	*	*			trans	131.9	144.4	136.2	-76	-172.6	172.6	-168.8	0	116.6
403	E	51.2	Low	46.9	Very low	169 Å²	169	150.3 Å²	150.3	79%	0.79	83%	0.832	S	S	*	*			trans	64.7	125.2	159.9	-67.5	155.3	-140.9	0	0	114.6
404	I	58.4	Low	47.2	Very low	242 Å²	242	148.5 Å²	148.5	100%	1.241	83%	0.825	S	S	*	*			cis	-129.1	0	28.6	-69.5	166.7	0	0	0	111.4

Retrieved 404 of 404 residues in 852.3 ms (Link to these results)

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