A0A078BQH9_CAEEL Loading...

Cyclin N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BQH9, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 217 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	33.8	Very low	45.6	Very low	239 Å²	239	123.5 Å²	123.5	100%	1.177	66%	0.66	S	S	*	*				0	120.3	0	-72.1	-179.7	-131.2	0	0	105.8	A3	M1-A3 PolarHBondContact O-N 3.13Å
2	F	33.6	Very low	44.8	Very low	209 Å²	209	123.4 Å²	123.4	92%	0.917	67%	0.667	S	S	*	*			trans	-74	124.9	-168.5	-68.3	-89.9	0	0	0	109.1	E4	F2-E4 PolarHBondContact O-N 3.3Å
3	A	38.3	Very low	44.3	Very low	46 Å²	46	126.5 Å²	126.5	38%	0.38	68%	0.683	S	S	.	*			trans	-64.6	117.9	166.1	0	0	0	0	0	107.3	M1 T5	M1-A3 PolarHBondContact O-N 3.13Å; A3-T5 PolarHBondContact O-N 3.28Å
4	E	47.3	Very low	43.7	Very low	172 Å²	172	134 Å²	134	80%	0.804	70%	0.696	S	S	*	*			trans	-59.2	104	168.8	-71.8	-178.2	154	0	0	106.6	F2 L138	F2-E4 PolarHBondContact O-N 3.3Å; E4-L138 WeakPolarHBondContact O-CD2 3.26Å
5	T	56.9	Low	42.8	Very low	59 Å²	59	135.5 Å²	135.5	36%	0.362	71%	0.706	S	S	.	*			trans	-65	156.5	174.1	-60.3	0	0	0	0	107.5	A3 E7 N143	A3-T5 PolarHBondContact O-N 3.28Å; T5-E7 VanDerWaalsContact C-N 3.31Å; T5-E7 PolarHBondContact O-N 3.37Å; T5-N143 WeakPolarHBondContact CG2-ND2 3.44Å
6	I	67.2	Low	42.2	Very low	13 Å²	13	133.8 Å²	133.8	7%	0.067	71%	0.709	C	S	.	*			trans	-58.6	100.3	167.6	-61.9	168.9	0	0	0	107.7	V8 I133 L138 V147 Y187 P190 V194	I6-V8 HydrophobicContact CG2-CG2 4.39Å; I6-V8 PolarHBondContact O-N 2.96Å; I6-I133 HydrophobicContact CD1-CG2 3.85Å; I6-L138 HydrophobicContact CD1-CB 4.29Å; I6-L138 HydrophobicContact CG1-CB 3.94Å; I6-L138 HydrophobicContact CG1-CD1 4.45Å; I6-V147 HydrophobicContact CD1-CG2 3.97Å; I6-Y187 HydrophobicContact CB-CD1 4.48Å; I6-Y187 HydrophobicContact CB-CE1 3.96Å; I6-Y187 HydrophobicContact CG2-CD1 3.76Å; I6-Y187 HydrophobicContact CG2-CE1 3.56Å; I6-P190 HydrophobicContact CG2-CB 3.59Å; I6-V194 HydrophobicContact CD1-CG2 4.29Å; I6-V194 HydrophobicContact CG1-CG2 4.07Å
7	E	52.1	Low	41.4	Very low	171 Å²	171	132.2 Å²	132.2	80%	0.799	71%	0.711	S	S	*	*			trans	-85.2	109.5	178	-70.4	-161.8	164.2	0	0	108.8	T5	T5-E7 VanDerWaalsContact C-N 3.31Å; T5-E7 PolarHBondContact O-N 3.37Å
8	V	52.9	Low	40.7	Very low	40 Å²	40	136.4 Å²	136.4	24%	0.242	72%	0.717	C	S	.	*	P	Polyproline II helix	trans	-92.8	124.3	166.1	-178.8	0	0	0	0	107.1	I6 Q10 A186 Y187 P190	I6-V8 HydrophobicContact CG2-CG2 4.39Å; I6-V8 PolarHBondContact O-N 2.96Å; V8-Q10 PolarHBondContact O-N 3.37Å; V8-A186 HydrophobicContact CG1-CB 3.57Å; V8-Y187 HydrophobicContact CB-CE2 4.38Å; V8-Y187 HydrophobicContact CG2-CD1 3.91Å; V8-Y187 HydrophobicContact CG2-CD2 3.82Å; V8-Y187 HydrophobicContact CG2-CE1 3.66Å; V8-Y187 HydrophobicContact CG2-CE2 3.57Å; V8-Y187 HydrophobicContact CG2-CG 3.99Å; V8-Y187 VanDerWaalsContact CG2-CZ 3.47Å; V8-P190 HydrophobicContact CG2-CG 4.26Å
9	P	42.2	Very low	40.2	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-55.4	124.4	174.3	-22.8	31.7	0	0	0	110.2	A11	P9-A11 PolarHBondContact O-N 3.2Å
10	Q	37.2	Very low	39.8	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-63	130.6	175.9	-74.7	-171.1	-30.8	0	0	110.1	V8 V12	V8-Q10 PolarHBondContact O-N 3.37Å; Q10-V12 PolarHBondContact O-N 3.02Å
11	A	40.4	Very low	39.4	Very low	106 Å²	106	140.4 Å²	140.4	88%	0.876	73%	0.73	S	S	*	*			trans	-64.4	102.8	175.9	0	0	0	0	0	109.9	P9 N13	P9-A11 PolarHBondContact O-N 3.2Å; A11-N13 PolarHBondContact O-N 3.47Å
12	V	36.1	Very low	39.1	Very low	123 Å²	123	135.6 Å²	135.6	75%	0.745	72%	0.715	S	S	*	*			trans	-66.6	117.6	167.8	179.5	0	0	0	0	107.4	Q10 R14	Q10-V12 PolarHBondContact O-N 3.02Å; V12-R14 PolarHBondContact O-N 3Å; V12-R14 VanDerWaalsContact O-N 3.13Å
13	N	38.3	Very low	39.2	Very low	163 Å²	163	130.7 Å²	130.7	87%	0.872	71%	0.706	S	S	*	*			trans	-48.5	116.2	167.2	-121.3	-34.5	0	0	0	109.4	A11	A11-N13 PolarHBondContact O-N 3.47Å
14	R	36	Very low	39.1	Very low	232 Å²	232	136 Å²	136	88%	0.875	73%	0.726	S	S	*	*			trans	-152	122.1	166.6	-112.6	174.9	-178.2	-177.1	-0.3	111.2	V12	V12-R14 PolarHBondContact O-N 3Å; V12-R14 VanDerWaalsContact O-N 3.13Å
15	D	29	Very low	38.5	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	73%	0.726	S	S	*	*			trans	-53.7	158.2	178.8	-70	-68.5	0	0	0	114.7
16	S	33.5	Very low	37.5	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	75%	0.75	S	S	*	*			trans	-48.6	158.7	169.9	3.7	0	0	0	0	115.6
17	S	28.8	Very low	35.9	Very low	107 Å²	107	148.8 Å²	148.8	75%	0.748	78%	0.784	S	S	*	*			trans	98.7	128.8	173.2	-34.3	0	0	0	0	112.1
18	Y	28.9	Very low	35	Very low	209 Å²	209	146.6 Å²	146.6	82%	0.82	79%	0.786	S	S	*	*			cis	-167	152.5	32.7	42.9	-90.5	0	0	0	111.7
19	E	31.7	Very low	33.9	Very low	188 Å²	188	151.1 Å²	151.1	88%	0.879	81%	0.809	S	S	*	*			trans	51.2	147.7	138.3	-60.4	-92.1	127.5	0	0	124.2
20	R	32.5	Very low	33.8	Very low	243 Å²	243	153.7 Å²	153.7	92%	0.917	82%	0.815	S	S	*	*			trans	-89.6	140.6	-173.1	172.4	-167.9	-66.9	-158.4	-2.1	111.3
21	G	30.4	Very low	33.6	Very low	61 Å²	61	152.1 Å²	152.1	63%	0.629	81%	0.813	S	S	*	*			trans	178.6	102.8	162	0	0	0	0	0	111.4
22	T	28.2	Very low	33.8	Very low	139 Å²	139	151.3 Å²	151.3	85%	0.853	81%	0.806	S	S	*	*				57.9	109	103.3	55	0	0	0	0	117
23	S	35.3	Very low	33.7	Very low	106 Å²	106	150.2 Å²	150.2	74%	0.741	80%	0.804	S	S	*	*			trans	36.3	122.5	142.4	-160.7	0	0	0	0	120
24	I	35.2	Very low	33.7	Very low	156 Å²	156	153 Å²	153	80%	0.8	80%	0.802	S	S	*	*			trans	-156.9	126.2	133	-87.9	136.4	0	0	0	107.8
25	D	35.1	Very low	33.6	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	79%	0.794	S	S	*	*			trans	-59.8	128.8	165.3	-74.4	-71.2	0	0	0	110.5
26	E	35.9	Very low	33.8	Very low	186 Å²	186	146 Å²	146	87%	0.869	79%	0.79	S	S	*	*			trans	-144.9	119.5	153.3	-113.7	175.9	153.3	0	0	111.3
27	K	35	Very low	33.8	Very low	178 Å²	178	148.9 Å²	148.9	77%	0.774	79%	0.792	S	S	*	*			trans	-77.6	121.1	-178.3	179.8	-174.8	-180	-172.9	0	108.3
28	C	32.8	Very low	33.9	Very low	126 Å²	126	149 Å²	149	85%	0.851	79%	0.79	S	S	*	*			trans	-127	122.9	164.5	-81.3	0	0	0	0	109.4
29	D	30	Very low	34.2	Very low	134 Å²	134	143.1 Å²	143.1	72%	0.717	78%	0.78	S	S	*	*			trans	-64.4	145.8	-165.5	-63.1	-63.3	0	0	0	113.9	D31	D29-D31 PolarHBondContact O-N 3.12Å
30	L	40.1	Very low	34.5	Very low	174 Å²	174	139.6 Å²	139.6	91%	0.911	78%	0.776	S	S	*	*			trans	-61.2	121.7	166.9	-76.4	98.1	0	0	0	109.6
31	D	31.4	Very low	35.3	Very low	151 Å²	151	136 Å²	136	81%	0.807	77%	0.769	S	S	*	*			trans	-122.6	111.4	150.7	-152.8	-15.6	0	0	0	109.7	D29 S33	D29-D31 PolarHBondContact O-N 3.12Å; D31-S33 PolarHBondContact O-N 3.19Å
32	A	45.6	Very low	36.1	Very low	88 Å²	88	139.1 Å²	139.1	73%	0.727	78%	0.776	S	S	*	*			trans	-87.2	90	-176.8	0	0	0	0	0	108.8
33	S	34.3	Very low	37	Very low	101 Å²	101	139.3 Å²	139.3	71%	0.706	77%	0.77	S	S	*	*			trans	-104.5	82.2	160	-65.2	0	0	0	0	108.3	D31 S35	D31-S33 PolarHBondContact O-N 3.19Å; S33-S35 VanDerWaalsContact C-N 3.33Å; S33-S35 PolarHBondContact O-N 2.82Å
34	R	39	Very low	38	Very low	220 Å²	220	140.2 Å²	140.2	83%	0.83	77%	0.767	S	S	*	*			trans	-69.3	92.2	170.5	-171.3	179.4	-172.9	175.1	1.4	107.4	D36	R34-D36 PolarHBondContact O-N 2.76Å
35	S	31.8	Very low	39.8	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	77%	0.768	S	S	*	*			trans	-64.9	109.5	162.7	-44.4	0	0	0	0	106.7	S33 E37	S33-S35 VanDerWaalsContact C-N 3.33Å; S33-S35 PolarHBondContact O-N 2.82Å; S35-E37 PolarHBondContact O-N 3.45Å
36	D	35.2	Very low	42.2	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	73%	0.734	S	S	*	*			trans	-65.7	81.9	168.4	-72.5	-40.2	0	0	0	108.5	R34	R34-D36 PolarHBondContact O-N 2.76Å
37	E	33.4	Very low	44.7	Very low	166 Å²	166	129.8 Å²	129.8	78%	0.776	71%	0.712	S	S	*	*			trans	-64.8	129.6	157.9	-92.1	-84.1	127.5	0	0	107	S35 S39	S35-E37 PolarHBondContact O-N 3.45Å; E37-S39 PolarHBondContact O-N 3.18Å
38	P	30.8	Very low	47.2	Very low	110 Å²	110	122.2 Å²	122.2	71%	0.714	68%	0.681	S	S	*	*			trans	-62.2	112.1	-178.5	26.4	-31.5	0	0	0	107.9	S40	P38-S40 PolarHBondContact O-N 3.36Å
39	S	34.3	Very low	49.7	Very low	86 Å²	86	119.4 Å²	119.4	60%	0.601	66%	0.656	S	S	*	*			trans	-54.2	109.5	169.3	47.6	0	0	0	0	107.3	E37 E41	E37-S39 PolarHBondContact O-N 3.18Å; S39-E41 PolarHBondContact O-N 3.37Å
40	S	38.3	Very low	52.3	Low	114 Å²	114	113.3 Å²	113.3	80%	0.797	62%	0.624	S	S	*	*			trans	-68.3	70.6	166.6	45.3	0	0	0	0	108.2	P38 V42	P38-S40 PolarHBondContact O-N 3.36Å; S40-V42 PolarHBondContact O-N 3.21Å; S40-V42 VanDerWaalsContact O-N 3.13Å
41	E	48.7	Very low	54.4	Low	166 Å²	166	105.2 Å²	105.2	78%	0.776	58%	0.582	S	S	*	*			trans	-78.5	71.2	168.3	-76.7	-176.6	-171.5	0	0	109.2	S39	S39-E41 PolarHBondContact O-N 3.37Å
42	V	48.2	Very low	56.6	Low	127 Å²	127	99.7 Å²	99.7	77%	0.77	56%	0.555	S	S	*	*			trans	-160.6	111.7	161.9	-135.8	0	0	0	0	104.4	S40	S40-V42 PolarHBondContact O-N 3.21Å; S40-V42 VanDerWaalsContact O-N 3.13Å
43	I	46.5	Very low	58	Low	144 Å²	144	101.1 Å²	101.1	74%	0.738	55%	0.547	S	S	*	.				-154.6	116.4	52.3	-65.3	150.9	0	0	0	106.5
44	D	56.2	Low	59.8	Low	124 Å²	124	97.3 Å²	97.3	66%	0.663	52%	0.518	S	S	*	.			trans	-101	2.1	179.2	-144.4	9.4	0	0	0	112.9	Y46 R198	D44-Y46 PolarHBondContact O-N 3.5Å; D44-R198 VanDerWaalsContact CG-NH1 3.26Å; D44-R198 IonicContact OD1-NH1 3.71Å; D44-R198 PolarHBondContact OD1-NH1 2.92Å; D44-R198 IonicContact OD2-CZ 2.65Å; D44-R198 IonicContact OD2-NH1 3.76Å; D44-R198 PolarHBondContact OD2-NH1 3.35Å; D44-R198 IonicContact OD2-NH2 2.62Å
45	E	73.3	Confident	60.9	Low	177 Å²	177	88.4 Å²	88.4	83%	0.827	50%	0.495	S	S	*	.			trans	-100.7	87.1	178.5	-157.5	162.6	-154.4	0	0	109.5
46	Y	86.1	Confident	62.6	Low	21 Å²	21	88.4 Å²	88.4	8%	0.082	49%	0.486	C	S	.	.			trans	-73.6	120.1	172.1	164	-105.9	0	0	0	109.8	D44 P48 V128 E131 K132 L135 E205 H209	D44-Y46 PolarHBondContact O-N 3.5Å; Y46-P48 HydrophobicContact CE1-CB 3.93Å; Y46-P48 WeakPolarHBondContact O-CD 3.35Å; Y46-V128 HydrophobicContact CD1-CG1 4.17Å; Y46-V128 HydrophobicContact CE1-CB 4.35Å; Y46-V128 HydrophobicContact CE1-CG1 3.66Å; Y46-V128 HydrophobicContact CE1-CG2 4.11Å; Y46-E131 HydrophobicContact CE2-CB 3.71Å; Y46-E131 PolarHBondContact OH-OE2 3.07Å; Y46-K132 HydrophobicContact CD1-CG 4.5Å; Y46-K132 HydrophobicContact CD2-CG 3.87Å; Y46-K132 HydrophobicContact CE2-CG 4.35Å; Y46-K132 HydrophobicContact CG-CD 4.49Å; Y46-K132 HydrophobicContact CG-CG 3.93Å; Y46-L135 HydrophobicContact CD2-CD1 3.58Å; Y46-L135 HydrophobicContact CE2-CD1 4.18Å; Y46-E205 HydrophobicContact CD1-CB 4.06Å; Y46-E205 HydrophobicContact CD1-CG 3.77Å; Y46-E205 WeakPolarHBondContact CD1-OE1 3.49Å; Y46-E205 HydrophobicContact CE1-CB 3.96Å; Y46-E205 HydrophobicContact CE1-CG 4.19Å; Y46-H209 PolarHBondContact OH-NE2 2.97Å
47	D	88.1	Confident	64.1	Low	75 Å²	75	83.4 Å²	83.4	40%	0.401	47%	0.468	S	S	.	.			trans	-94.4	112.6	173	170.9	12.3	0	0	0	110.5	I49 A50	D47-I49 PolarHBondContact O-N 2.65Å; D47-I49 PolarHBondContact OD1-N 2.62Å; D47-A50 HydrophobicContact CB-CB 3.99Å; D47-A50 VanDerWaalsContact O-CB 3.25Å; D47-A50 WeakPolarHBondContact O-CB 3.11Å; D47-A50 PolarHBondContact O-N 3.31Å; D47-A50 PolarHBondContact OD2-N 3.03Å
48	P	87.3	Confident	65.9	Low	19 Å²	19	81.4 Å²	81.4	12%	0.123	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-10.6	-177.3	29.2	-36.2	0	0	0	114.3	Y46 E205 P208	Y46-P48 HydrophobicContact CE1-CB 3.93Å; Y46-P48 WeakPolarHBondContact O-CD 3.35Å; P48-E205 WeakPolarHBondContact CB-O 3.33Å; P48-P208 HydrophobicContact CB-CB 4.33Å; P48-P208 HydrophobicContact CB-CG 3.99Å; P48-P208 HydrophobicContact CG-CG 3.88Å
49	I	85.9	Confident	68.2	Low	67 Å²	67	83.9 Å²	83.9	34%	0.344	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-13.3	-179.5	-59.4	172.9	0	0	0	111.3	D47 F51 S52 E53 P208	D47-I49 PolarHBondContact O-N 2.65Å; D47-I49 PolarHBondContact OD1-N 2.62Å; I49-F51 VanDerWaalsContact C-N 3.27Å; I49-F51 PolarHBondContact O-N 3.08Å; I49-S52 PolarHBondContact O-N 2.93Å; I49-E53 HydrophobicContact CG2-CG 3.75Å; I49-E53 PolarHBondContact O-N 3.14Å; I49-P208 HydrophobicContact CG1-CB 4.26Å; I49-P208 HydrophobicContact CG1-CG 4.44Å
50	A	84.4	Confident	70.5	Confident	5 Å²	5	83.1 Å²	83.1	4%	0.041	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-40.4	-173	0	0	0	0	0	115	D47 L54	D47-A50 HydrophobicContact CB-CB 3.99Å; D47-A50 VanDerWaalsContact O-CB 3.25Å; D47-A50 WeakPolarHBondContact O-CB 3.11Å; D47-A50 PolarHBondContact O-N 3.31Å; D47-A50 PolarHBondContact OD2-N 3.03Å; A50-L54 WeakPolarHBondContact O-CD1 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.23Å
51	F	83	Confident	72.8	Confident	4 Å²	4	80 Å²	80	2%	0.018	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-16.2	-179.2	-64	-59.1	0	0	0	114.5	I49 L54 F88 Y92 I95 M102 E131 I134 L135	I49-F51 VanDerWaalsContact C-N 3.27Å; I49-F51 PolarHBondContact O-N 3.08Å; F51-L54 HydrophobicContact CD1-CD1 4.01Å; F51-L54 WeakPolarHBondContact O-CB 3.27Å; F51-F88 AromaticContact CD1-CE2 3.79Å; F51-F88 HydrophobicContact CD1-CE2 3.79Å; F51-F88 AromaticContact CE1-CE2 3.76Å; F51-F88 HydrophobicContact CE1-CE2 3.76Å; F51-F88 HydrophobicContact CE1-CZ 4.24Å; F51-Y92 HydrophobicContact CD1-CE2 4.33Å; F51-Y92 HydrophobicContact CE1-CD2 4.38Å; F51-Y92 HydrophobicContact CE1-CE2 4.01Å; F51-I95 HydrophobicContact CE1-CD1 4.1Å; F51-I95 HydrophobicContact CZ-CD1 4.26Å; F51-M102 HydrophobicContact CB-CE 3.76Å; F51-M102 HydrophobicContact CD1-CE 3.55Å; F51-M102 HydrophobicContact CD1-SD 4.11Å; F51-M102 HydrophobicContact CD2-CE 4.42Å; F51-M102 HydrophobicContact CD2-SD 4.29Å; F51-M102 HydrophobicContact CE1-CE 4.19Å; F51-M102 HydrophobicContact CE1-SD 4.28Å; F51-M102 HydrophobicContact CE2-SD 4.45Å; F51-M102 HydrophobicContact CG-CE 3.65Å; F51-M102 HydrophobicContact CG-SD 4.08Å; F51-M102 HydrophobicContact CZ-SD 4.42Å; F51-E131 HydrophobicContact CD2-CB 4.19Å; F51-E131 VanDerWaalsContact CD2-CD 3.43Å; F51-E131 HydrophobicContact CD2-CG 3.82Å; F51-E131 VanDerWaalsContact CD2-OE1 3.32Å; F51-E131 WeakPolarHBondContact CD2-OE1 3.42Å; F51-E131 HydrophobicContact CE2-CB 3.86Å; F51-E131 HydrophobicContact CE2-CG 3.91Å; F51-I134 HydrophobicContact CE1-CG2 4.43Å; F51-I134 HydrophobicContact CZ-CG2 3.86Å; F51-L135 HydrophobicContact CE1-CD2 4.28Å; F51-L135 HydrophobicContact CE2-CD1 4.32Å; F51-L135 HydrophobicContact CE2-CD2 4.05Å; F51-L135 HydrophobicContact CE2-CG 3.96Å; F51-L135 HydrophobicContact CZ-CD2 3.47Å; F51-L135 VanDerWaalsContact CZ-CD2 3.47Å; F51-L135 HydrophobicContact CZ-CG 3.74Å
52	S	77.7	Confident	74.8	Confident	35 Å²	35	75.6 Å²	75.6	25%	0.245	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-26.5	-174.7	-64.5	0	0	0	0	112.9	I49 L54 R212	I49-S52 PolarHBondContact O-N 2.93Å; S52-L54 PolarHBondContact O-N 3.5Å; S52-R212 PolarHBondContact OG-NH1 3.26Å; S52-R212 PolarHBondContact OG-NH2 2.92Å
53	E	75.6	Confident	77	Confident	118 Å²	118	78.7 Å²	78.7	55%	0.551	40%	0.398	S	S	*	.	S	Bend	trans	-66.8	-23.3	165.8	-68	-175.1	162.3	0	0	112	I49 G55 I56	I49-E53 HydrophobicContact CG2-CG 3.75Å; I49-E53 PolarHBondContact O-N 3.14Å; E53-G55 PolarHBondContact O-N 3.26Å; E53-I56 PolarHBondContact O-N 3.27Å
54	L	71.4	Confident	79	Confident	22 Å²	22	77.7 Å²	77.7	12%	0.115	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	123	177.9	-56.3	168	0	0	0	110	A50 F51 S52 F88 K91 Y92 L99 K103	A50-L54 WeakPolarHBondContact O-CD1 3.29Å; A50-L54 WeakPolarHBondContact O-CG 3.23Å; F51-L54 HydrophobicContact CD1-CD1 4.01Å; F51-L54 WeakPolarHBondContact O-CB 3.27Å; S52-L54 PolarHBondContact O-N 3.5Å; L54-F88 HydrophobicContact CD1-CD2 3.63Å; L54-F88 HydrophobicContact CD1-CE2 4.11Å; L54-K91 HydrophobicContact CD2-CD 4.15Å; L54-Y92 HydrophobicContact CD1-CD2 4.4Å; L54-Y92 HydrophobicContact CD1-CE2 3.61Å; L54-L99 HydrophobicContact CB-CD1 4.27Å; L54-L99 HydrophobicContact CB-CD2 3.73Å; L54-K103 PolarHBondContact O-NZ 3.06Å
55	G	62.8	Low	80.7	Confident	32 Å²	32	81.8 Å²	81.8	33%	0.33	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.7	1.2	-177.4	0	0	0	0	0	115.1	E53 G57	E53-G55 PolarHBondContact O-N 3.26Å; G55-G57 PolarHBondContact O-N 2.88Å
56	I	67.8	Low	81.4	Confident	104 Å²	104	79.3 Å²	79.3	53%	0.533	41%	0.406	S	S	.	.			trans	-70.9	110.6	162.1	-56.9	176.7	0	0	0	106.2	E53	E53-I56 PolarHBondContact O-N 3.27Å
57	G	65.3	Low	81.4	Confident	36 Å²	36	81.3 Å²	81.3	37%	0.371	42%	0.423	S	S	.	.			trans	-51.5	151.3	-179.3	0	0	0	0	0	112.1	G55 R59	G55-G57 PolarHBondContact O-N 2.88Å; G57-R59 PolarHBondContact O-N 3.36Å
58	K	71.4	Confident	81.6	Confident	124 Å²	124	82.7 Å²	82.7	54%	0.539	43%	0.434	S	S	.	.			trans	-55.2	117.2	-177.9	-68.8	-179.9	-178.9	173.5	0	109.8	H73	K58-H73 HydrophobicContact CB-CB 4.37Å; K58-H73 WeakPolarHBondContact O-CB 3.22Å; K58-H73 PolarHBondContact O-N 3.35Å; K58-H73 PolarHBondContact O-ND1 2.86Å
59	R	78.8	Confident	81.6	Confident	161 Å²	161	84 Å²	84	61%	0.608	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.6	179.4	71.3	-179.8	179.4	167.3	-2.6	110.4	G57 V61 T71 L72	G57-R59 PolarHBondContact O-N 3.36Å; R59-V61 HydrophobicContact CG-CG2 4.39Å; R59-T71 WeakPolarHBondContact CA-O 3.31Å; R59-L72 HydrophobicContact CB-CD2 3.87Å
60	T	82.6	Confident	81.7	Confident	71 Å²	71	83.9 Å²	83.9	44%	0.436	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.9	167.8	-65.6	0	0	0	0	108.2	I62 S70 T71 H73	T60-I62 HydrophobicContact CG2-CG1 4.47Å; T60-S70 WeakPolarHBondContact O-CA 3.35Å; T60-T71 PolarHBondContact N-O 3.36Å; T60-T71 PolarHBondContact O-N 3.27Å; T60-H73 PolarHBondContact OG1-CE1 2.94Å; T60-H73 VanDerWaalsContact OG1-CE1 3.26Å
61	V	87.9	Confident	81.7	Confident	49 Å²	49	87.4 Å²	87.4	30%	0.297	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121	176.4	-176.9	0	0	0	0	108.3	R59 R63 V68	R59-V61 HydrophobicContact CG-CG2 4.39Å; V61-R63 HydrophobicContact CG1-CG 4.08Å; V61-V68 HydrophobicContact CG1-CG1 3.56Å
62	I	91.1	Very high	81.6	Confident	73 Å²	73	92.2 Å²	92.2	37%	0.374	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.8	174.4	-55.1	172	0	0	0	106.7	T60 A69	T60-I62 HydrophobicContact CG2-CG1 4.47Å; I62-A69 HydrophobicContact CB-CB 4.43Å; I62-A69 PolarHBondContact N-O 2.83Å; I62-A69 PolarHBondContact O-N 3.12Å
63	R	92.9	Very high	81.5	Confident	191 Å²	191	95.5 Å²	95.5	72%	0.721	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.1	177.5	-65.2	-176.8	-130.9	-91.3	-0.4	109.5	V61 V68	V61-R63 HydrophobicContact CG1-CG 4.08Å; R63-V68 HydrophobicContact CG-CG1 4.39Å; R63-V68 HydrophobicContact CG-CG2 4.39Å
64	H	89.1	Confident	81.1	Confident	123 Å²	123	95.8 Å²	95.8	57%	0.569	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	165.5	167.6	-74.1	-76.4	0	0	0	109.8	C66 C67	H64-C66 PolarHBondContact O-N 2.92Å; H64-C66 VanDerWaalsContact O-N 3.07Å; H64-C67 PolarHBondContact N-O 3.19Å; H64-C67 PolarHBondContact O-N 3.35Å; H64-C67 VanDerWaalsContact O-O 3.05Å
65	E	91.2	Very high	81.3	Confident	210 Å²	210	98.9 Å²	98.9	98%	0.981	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.5	-175.4	-64	-178.9	167.4	0	0	113.8
66	C	88.3	Confident	82.1	Confident	125 Å²	125	100.5 Å²	100.5	85%	0.845	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	-2.5	-179.2	64.6	0	0	0	0	115	H64	H64-C66 PolarHBondContact O-N 2.92Å; H64-C66 VanDerWaalsContact O-N 3.07Å
67	C	86.4	Confident	82.6	Confident	64 Å²	64	99.7 Å²	99.7	43%	0.432	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-152.8	152.7	-178.4	67.2	0	0	0	0	113.3	H64	H64-C67 PolarHBondContact N-O 3.19Å; H64-C67 PolarHBondContact O-N 3.35Å; H64-C67 VanDerWaalsContact O-O 3.05Å
68	V	92.7	Very high	83.3	Confident	104 Å²	104	105.7 Å²	105.7	63%	0.63	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.1	113	169.8	-177.7	0	0	0	0	107.3	V61 R63	V61-V68 HydrophobicContact CG1-CG1 3.56Å; R63-V68 HydrophobicContact CG-CG1 4.39Å; R63-V68 HydrophobicContact CG-CG2 4.39Å
69	A	88.3	Confident	83.7	Confident	47 Å²	47	107.3 Å²	107.3	39%	0.388	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.9	151.1	172.6	0	0	0	0	0	109.6	I62	I62-A69 HydrophobicContact CB-CB 4.43Å; I62-A69 PolarHBondContact N-O 2.83Å; I62-A69 PolarHBondContact O-N 3.12Å
70	S	86.6	Confident	83.7	Confident	63 Å²	63	101.3 Å²	101.3	44%	0.441	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.8	128.8	175.7	178.2	0	0	0	0	109.8	T60	T60-S70 WeakPolarHBondContact O-CA 3.35Å
71	T	85.1	Confident	83.6	Confident	79 Å²	79	103.5 Å²	103.5	49%	0.485	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	124.3	173.7	-54.3	0	0	0	0	109.2	R59 T60	R59-T71 WeakPolarHBondContact CA-O 3.31Å; T60-T71 PolarHBondContact N-O 3.36Å; T60-T71 PolarHBondContact O-N 3.27Å
72	L	80.6	Confident	83.4	Confident	106 Å²	106	106.2 Å²	106.2	56%	0.555	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87	130.6	173.6	-67.5	168.4	0	0	0	109.4	R59 C74	R59-L72 HydrophobicContact CB-CD2 3.87Å; L72-C74 PolarHBondContact O-N 3.34Å; L72-C74 VanDerWaalsContact O-N 3.17Å
73	H	75.9	Confident	82.9	Confident	104 Å²	104	104.3 Å²	104.3	48%	0.481	56%	0.561	S	S	.	*			trans	-76.8	102.9	173.7	-69.4	67.1	0	0	0	108.7	K58 T60 E75	K58-H73 HydrophobicContact CB-CB 4.37Å; K58-H73 WeakPolarHBondContact O-CB 3.22Å; K58-H73 PolarHBondContact O-N 3.35Å; K58-H73 PolarHBondContact O-ND1 2.86Å; T60-H73 PolarHBondContact OG1-CE1 2.94Å; T60-H73 VanDerWaalsContact OG1-CE1 3.26Å; H73-E75 PolarHBondContact O-N 3.19Å
74	C	66.3	Low	82.5	Confident	124 Å²	124	97 Å²	97	84%	0.838	54%	0.536	S	S	*	.			trans	-85	98.5	176.4	-64.7	0	0	0	0	109.7	L72	L72-C74 PolarHBondContact O-N 3.34Å; L72-C74 VanDerWaalsContact O-N 3.17Å
75	E	75.4	Confident	82.3	Confident	87 Å²	87	92.6 Å²	92.6	41%	0.407	52%	0.517	S	S	.	.			trans	-93.4	172.6	168.6	-62.5	-176.7	-174.7	0	0	110.6	H73 R79	H73-E75 PolarHBondContact O-N 3.19Å; E75-R79 HydrophobicContact CB-CB 4.14Å
76	S	81.5	Confident	82	Confident	66 Å²	66	87.2 Å²	87.2	46%	0.462	49%	0.492	S	S	.	.			trans	-57.9	145.2	169.9	70.6	0	0	0	0	109.9	E78 R79 A80	S76-E78 PolarHBondContact O-N 3.35Å; S76-E78 VanDerWaalsContact O-N 3.07Å; S76-R79 PolarHBondContact O-N 3.34Å; S76-R79 WeakPolarHBondContact OG-CB 3.44Å; S76-R79 WeakPolarHBondContact OG-CG 3.17Å; S76-R79 PolarHBondContact OG-N 2.76Å; S76-A80 PolarHBondContact O-N 2.99Å
77	A	77.9	Confident	81.8	Confident	86 Å²	86	85.3 Å²	85.3	71%	0.711	47%	0.473	S	S	*	.	H	α-helix	trans	-55.2	-32	-177.8	0	0	0	0	0	112.7	K81	A77-K81 VanDerWaalsContact O-CB 3.26Å; A77-K81 WeakPolarHBondContact O-CB 3.35Å; A77-K81 PolarHBondContact O-N 3.34Å; A77-K81 VanDerWaalsContact O-N 3.1Å
78	E	79.6	Confident	81.7	Confident	162 Å²	162	82.4 Å²	82.4	76%	0.757	45%	0.453	S	S	*	.	H	α-helix	trans	-67.3	-50.3	176	-64.1	172.1	169.1	0	0	112.2	S76 K81 Q82	S76-E78 PolarHBondContact O-N 3.35Å; S76-E78 VanDerWaalsContact O-N 3.07Å; E78-K81 PolarHBondContact O-N 3.36Å; E78-Q82 WeakPolarHBondContact O-CB 3.36Å; E78-Q82 PolarHBondContact O-N 3.31Å
79	R	79.3	Confident	81.4	Confident	159 Å²	159	83.9 Å²	83.9	60%	0.6	45%	0.453	S	S	*	.	H	α-helix	trans	-61.7	-47.8	177.5	-79.1	-85.6	-159	105.8	2.2	111.3	E75 S76 K81 Q82 V83	E75-R79 HydrophobicContact CB-CB 4.14Å; S76-R79 PolarHBondContact O-N 3.34Å; S76-R79 WeakPolarHBondContact OG-CB 3.44Å; S76-R79 WeakPolarHBondContact OG-CG 3.17Å; S76-R79 PolarHBondContact OG-N 2.76Å; R79-K81 VanDerWaalsContact C-N 3.33Å; R79-K81 PolarHBondContact O-N 3.23Å; R79-Q82 WeakPolarHBondContact O-CB 3.5Å; R79-Q82 PolarHBondContact O-N 3.48Å; R79-Q82 VanDerWaalsContact O-N 3.12Å; R79-V83 WeakPolarHBondContact O-CG2 3.36Å; R79-V83 PolarHBondContact O-N 3.49Å
80	A	79.2	Confident	81.2	Confident	34 Å²	34	85.6 Å²	85.6	28%	0.281	47%	0.467	S	S	.	.	H	α-helix	trans	-58.2	-46.9	178.9	0	0	0	0	0	111.1	S76 Q82 V83 I84	S76-A80 PolarHBondContact O-N 2.99Å; A80-Q82 VanDerWaalsContact C-N 3.33Å; A80-Q82 PolarHBondContact O-N 2.88Å; A80-V83 PolarHBondContact O-N 3.19Å; A80-I84 WeakPolarHBondContact O-CB 2.96Å; A80-I84 VanDerWaalsContact O-CD1 3.27Å; A80-I84 WeakPolarHBondContact O-CD1 3.3Å; A80-I84 WeakPolarHBondContact O-CG1 3.31Å; A80-I84 PolarHBondContact O-N 3.09Å
81	K	80.7	Confident	81.2	Confident	117 Å²	117	87.8 Å²	87.8	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-62.3	-39.3	176.7	-178.7	-178.6	176.1	-173.5	0	112.4	A77 E78 R79 N85	A77-K81 VanDerWaalsContact O-CB 3.26Å; A77-K81 WeakPolarHBondContact O-CB 3.35Å; A77-K81 PolarHBondContact O-N 3.34Å; A77-K81 VanDerWaalsContact O-N 3.1Å; E78-K81 PolarHBondContact O-N 3.36Å; R79-K81 VanDerWaalsContact C-N 3.33Å; R79-K81 PolarHBondContact O-N 3.23Å; K81-N85 PolarHBondContact O-N 2.97Å; K81-N85 VanDerWaalsContact O-N 3.14Å; K81-N85 PolarHBondContact O-ND2 3.36Å
82	Q	82.7	Confident	81.2	Confident	107 Å²	107	85.8 Å²	85.8	50%	0.5	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-53	178.3	-178.4	175.9	1.7	0	0	110.9	E78 R79 A80 I84 N85 E86	E78-Q82 WeakPolarHBondContact O-CB 3.36Å; E78-Q82 PolarHBondContact O-N 3.31Å; R79-Q82 WeakPolarHBondContact O-CB 3.5Å; R79-Q82 PolarHBondContact O-N 3.48Å; R79-Q82 VanDerWaalsContact O-N 3.12Å; A80-Q82 VanDerWaalsContact C-N 3.33Å; A80-Q82 PolarHBondContact O-N 2.88Å; Q82-I84 VanDerWaalsContact C-N 3.28Å; Q82-I84 PolarHBondContact O-N 3.05Å; Q82-N85 PolarHBondContact O-N 2.85Å; Q82-E86 HydrophobicContact CG-CG 4.35Å; Q82-E86 WeakPolarHBondContact CG-OE1 3.37Å; Q82-E86 PolarHBondContact NE2-OE1 3.08Å; Q82-E86 WeakPolarHBondContact O-CG 3.48Å; Q82-E86 PolarHBondContact O-N 3.49Å
83	V	81.6	Confident	81.5	Confident	32 Å²	32	84.8 Å²	84.8	19%	0.194	45%	0.453	C	S	.	.	H	α-helix	trans	-56	-43.8	178.4	172.9	0	0	0	0	111.1	R79 A80 N85 E86 D87	R79-V83 WeakPolarHBondContact O-CG2 3.36Å; R79-V83 PolarHBondContact O-N 3.49Å; A80-V83 PolarHBondContact O-N 3.19Å; V83-N85 VanDerWaalsContact C-N 3.33Å; V83-N85 PolarHBondContact O-N 3.34Å; V83-E86 PolarHBondContact O-N 2.8Å; V83-D87 WeakPolarHBondContact O-CB 3.35Å; V83-D87 VanDerWaalsContact O-CG 3.32Å; V83-D87 PolarHBondContact O-N 3.08Å
84	I	83.8	Confident	81.8	Confident	39 Å²	39	85.9 Å²	85.9	20%	0.2	46%	0.459	C	S	.	.	H	α-helix	trans	-62.3	-39.3	179	-69.9	166	0	0	0	112.1	A80 Q82 F88 L99	A80-I84 WeakPolarHBondContact O-CB 2.96Å; A80-I84 VanDerWaalsContact O-CD1 3.27Å; A80-I84 WeakPolarHBondContact O-CD1 3.3Å; A80-I84 WeakPolarHBondContact O-CG1 3.31Å; A80-I84 PolarHBondContact O-N 3.09Å; Q82-I84 VanDerWaalsContact C-N 3.28Å; Q82-I84 PolarHBondContact O-N 3.05Å; I84-F88 WeakPolarHBondContact O-CB 3.46Å; I84-F88 PolarHBondContact O-N 2.91Å; I84-F88 VanDerWaalsContact O-N 3.14Å; I84-L99 HydrophobicContact CG2-CD2 3.32Å
85	N	84.7	Confident	82.9	Confident	29 Å²	29	80.7 Å²	80.7	16%	0.155	42%	0.423	C	S	.	.	H	α-helix	trans	-75.8	-35.6	178.5	-68.8	-38.7	0	0	0	111.8	K81 Q82 V83 F88 E89	K81-N85 PolarHBondContact O-N 2.97Å; K81-N85 VanDerWaalsContact O-N 3.14Å; K81-N85 PolarHBondContact O-ND2 3.36Å; Q82-N85 PolarHBondContact O-N 2.85Å; V83-N85 VanDerWaalsContact C-N 3.33Å; V83-N85 PolarHBondContact O-N 3.34Å; N85-F88 WeakPolarHBondContact O-CB 3.42Å; N85-F88 PolarHBondContact O-N 2.92Å; N85-E89 WeakPolarHBondContact O-CB 3.15Å; N85-E89 PolarHBondContact O-N 3.46Å
86	E	85.4	Confident	83.3	Confident	98 Å²	98	82.5 Å²	82.5	46%	0.458	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-46.1	174.2	-72.4	171.5	-177.7	0	0	111	Q82 V83 F88 E89 A90	Q82-E86 HydrophobicContact CG-CG 4.35Å; Q82-E86 WeakPolarHBondContact CG-OE1 3.37Å; Q82-E86 PolarHBondContact NE2-OE1 3.08Å; Q82-E86 WeakPolarHBondContact O-CG 3.48Å; Q82-E86 PolarHBondContact O-N 3.49Å; V83-E86 PolarHBondContact O-N 2.8Å; E86-F88 VanDerWaalsContact C-N 3.27Å; E86-F88 PolarHBondContact O-N 2.93Å; E86-E89 PolarHBondContact O-N 3.23Å; E86-A90 WeakPolarHBondContact O-CB 3.49Å; E86-A90 PolarHBondContact O-N 3.19Å
87	D	83.8	Confident	83.7	Confident	84 Å²	84	79.8 Å²	79.8	45%	0.449	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-37.9	174.8	-73	-17.4	0	0	0	111.4	V83 K91	V83-D87 WeakPolarHBondContact O-CB 3.35Å; V83-D87 VanDerWaalsContact O-CG 3.32Å; V83-D87 PolarHBondContact O-N 3.08Å; D87-K91 WeakPolarHBondContact O-CB 3.27Å; D87-K91 PolarHBondContact O-N 3.48Å
88	F	85.1	Confident	84.2	Confident	4 Å²	4	79 Å²	79	2%	0.018	40%	0.398	C	S	.	.	H	α-helix	trans	-65.7	-47.5	176.2	179.9	-88.7	0	0	0	112.1	F51 L54 I84 N85 E86 A90 K91 Y92 I95 L97 L99 M102	F51-F88 AromaticContact CD1-CE2 3.79Å; F51-F88 HydrophobicContact CD1-CE2 3.79Å; F51-F88 AromaticContact CE1-CE2 3.76Å; F51-F88 HydrophobicContact CE1-CE2 3.76Å; F51-F88 HydrophobicContact CE1-CZ 4.24Å; L54-F88 HydrophobicContact CD1-CD2 3.63Å; L54-F88 HydrophobicContact CD1-CE2 4.11Å; I84-F88 WeakPolarHBondContact O-CB 3.46Å; I84-F88 PolarHBondContact O-N 2.91Å; I84-F88 VanDerWaalsContact O-N 3.14Å; N85-F88 WeakPolarHBondContact O-CB 3.42Å; N85-F88 PolarHBondContact O-N 2.92Å; E86-F88 VanDerWaalsContact C-N 3.27Å; E86-F88 PolarHBondContact O-N 2.93Å; F88-A90 VanDerWaalsContact C-N 3.33Å; F88-K91 PolarHBondContact O-N 3.43Å; F88-Y92 HydrophobicContact CD2-CD2 4.02Å; F88-Y92 HydrophobicContact CD2-CE2 4.41Å; F88-Y92 AromaticContact CE2-CD2 3.89Å; F88-Y92 HydrophobicContact CE2-CD2 3.89Å; F88-Y92 HydrophobicContact CE2-CE2 4.3Å; F88-Y92 HydrophobicContact CZ-CD2 4.29Å; F88-Y92 PolarHBondContact O-N 3.1Å; F88-I95 HydrophobicContact CE1-CB 4.06Å; F88-I95 HydrophobicContact CE1-CD1 4.42Å; F88-I95 HydrophobicContact CE1-CG2 3.81Å; F88-I95 HydrophobicContact CZ-CB 4.23Å; F88-I95 HydrophobicContact CZ-CD1 3.81Å; F88-I95 HydrophobicContact CZ-CG2 3.83Å; F88-L97 WeakPolarHBondContact CE1-O 3.23Å; F88-L99 HydrophobicContact CB-CB 4.32Å; F88-L99 HydrophobicContact CD2-CB 3.91Å; F88-L99 HydrophobicContact CD2-CD1 4.07Å; F88-L99 HydrophobicContact CD2-CG 4.44Å; F88-L99 HydrophobicContact CE2-CB 4.43Å; F88-L99 HydrophobicContact CE2-CD1 4.21Å; F88-L99 HydrophobicContact CG-CB 4.03Å; F88-M102 HydrophobicContact CE2-CE 4.08Å
89	E	85.5	Confident	84.6	Confident	135 Å²	135	71.5 Å²	71.5	63%	0.631	36%	0.363	S	S	*	.	H	α-helix	trans	-65.7	-37.3	179.2	-172.9	171.1	-176.8	0	0	111.5	N85 E86 Y92 P93	N85-E89 WeakPolarHBondContact O-CB 3.15Å; N85-E89 PolarHBondContact O-N 3.46Å; E86-E89 PolarHBondContact O-N 3.23Å; E89-Y92 CarbonylContact O-C 3.4Å; E89-P93 WeakPolarHBondContact O-CA 3.49Å
90	A	85.3	Confident	85	Confident	83 Å²	83	66.1 Å²	66.1	69%	0.686	35%	0.35	S	S	*	.	H	α-helix	trans	-66.3	-40.8	174.2	0	0	0	0	0	112.6	E86 F88	E86-A90 WeakPolarHBondContact O-CB 3.49Å; E86-A90 PolarHBondContact O-N 3.19Å; F88-A90 VanDerWaalsContact C-N 3.33Å
91	K	85.3	Confident	85.6	Confident	109 Å²	109	67.4 Å²	67.4	47%	0.474	35%	0.349	S	S	.	.	H	α-helix	trans	-73.9	-33.2	179	-169.5	173.8	178.8	-177.5	0	112.2	L54 D87 F88	L54-K91 HydrophobicContact CD2-CD 4.15Å; D87-K91 WeakPolarHBondContact O-CB 3.27Å; D87-K91 PolarHBondContact O-N 3.48Å; F88-K91 PolarHBondContact O-N 3.43Å
92	Y	85.4	Confident	86.2	Confident	37 Å²	37	62 Å²	62	15%	0.145	33%	0.326	C	S	.	.			trans	-132.1	74	-176.3	-54.6	-78.9	0	0	0	112.7	F51 L54 F88 E89 M94 I95 L135	F51-Y92 HydrophobicContact CD1-CE2 4.33Å; F51-Y92 HydrophobicContact CE1-CD2 4.38Å; F51-Y92 HydrophobicContact CE1-CE2 4.01Å; L54-Y92 HydrophobicContact CD1-CD2 4.4Å; L54-Y92 HydrophobicContact CD1-CE2 3.61Å; F88-Y92 HydrophobicContact CD2-CD2 4.02Å; F88-Y92 HydrophobicContact CD2-CE2 4.41Å; F88-Y92 AromaticContact CE2-CD2 3.89Å; F88-Y92 HydrophobicContact CE2-CD2 3.89Å; F88-Y92 HydrophobicContact CE2-CE2 4.3Å; F88-Y92 HydrophobicContact CZ-CD2 4.29Å; F88-Y92 PolarHBondContact O-N 3.1Å; E89-Y92 CarbonylContact O-C 3.4Å; Y92-M94 PolarHBondContact O-N 3.38Å; Y92-M94 VanDerWaalsContact O-N 3.13Å; Y92-I95 HydrophobicContact CD1-CD1 3.86Å; Y92-I95 HydrophobicContact CD2-CD1 4.19Å; Y92-I95 HydrophobicContact CG-CD1 3.54Å; Y92-I95 HydrophobicContact CG-CG1 4.4Å; Y92-I95 PolarHBondContact O-N 3Å; Y92-L135 HydrophobicContact CD1-CD2 4.23Å; Y92-L135 HydrophobicContact CE1-CD2 3.79Å
93	P	86.1	Confident	86.7	Confident	85 Å²	85	61.4 Å²	61.4	55%	0.552	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-20.9	-176.4	25.8	-35.4	0	0	0	113.8	E89 I95	E89-P93 WeakPolarHBondContact O-CA 3.49Å; P93-I95 VanDerWaalsContact C-N 3.34Å
94	M	84.2	Confident	87.3	Confident	126 Å²	126	60.9 Å²	60.9	62%	0.621	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.8	178.6	-57.7	-60.7	154.3	0	0	112.9	Y92 H96 G137	Y92-M94 PolarHBondContact O-N 3.38Å; Y92-M94 VanDerWaalsContact O-N 3.13Å; M94-H96 PolarHBondContact O-N 3.23Å; M94-G137 WeakPolarHBondContact O-CA 3.46Å
95	I	87.6	Confident	87.9	Confident	15 Å²	15	59 Å²	59	8%	0.077	31%	0.31	C	S	.	.			trans	-91.5	108.2	-177.8	-58.5	176.6	0	0	0	109.9	F51 F88 Y92 P93 L97 I134	F51-I95 HydrophobicContact CE1-CD1 4.1Å; F51-I95 HydrophobicContact CZ-CD1 4.26Å; F88-I95 HydrophobicContact CE1-CB 4.06Å; F88-I95 HydrophobicContact CE1-CD1 4.42Å; F88-I95 HydrophobicContact CE1-CG2 3.81Å; F88-I95 HydrophobicContact CZ-CB 4.23Å; F88-I95 HydrophobicContact CZ-CD1 3.81Å; F88-I95 HydrophobicContact CZ-CG2 3.83Å; Y92-I95 HydrophobicContact CD1-CD1 3.86Å; Y92-I95 HydrophobicContact CD2-CD1 4.19Å; Y92-I95 HydrophobicContact CG-CD1 3.54Å; Y92-I95 HydrophobicContact CG-CG1 4.4Å; Y92-I95 PolarHBondContact O-N 3Å; P93-I95 VanDerWaalsContact C-N 3.34Å; I95-L97 HydrophobicContact CG2-CB 3.93Å; I95-L97 PolarHBondContact O-N 3.32Å; I95-L97 VanDerWaalsContact O-N 3.08Å; I95-I134 HydrophobicContact CD1-CG2 3.61Å; I95-I134 HydrophobicContact CG1-CG2 4.13Å; I95-I134 WeakPolarHBondContact CG1-O 3.36Å; I95-I134 HydrophobicContact CG2-CG2 3.89Å
96	H	85.6	Confident	88.4	Confident	126 Å²	126	58.7 Å²	58.7	58%	0.583	31%	0.307	S	S	*	.			trans	-85.6	40.3	176.2	-59.6	-57.1	0	0	0	113.4	M94	M94-H96 PolarHBondContact O-N 3.23Å
97	L	88.8	Confident	88.9	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.042	31%	0.31	C	S	.	.	S	Bend	trans	-142.2	131.3	-179.2	-175.7	69.2	0	0	0	110.1	F88 I95 K101 M102 L105 I139	F88-L97 WeakPolarHBondContact CE1-O 3.23Å; I95-L97 HydrophobicContact CG2-CB 3.93Å; I95-L97 PolarHBondContact O-N 3.32Å; I95-L97 VanDerWaalsContact O-N 3.08Å; L97-K101 HydrophobicContact CD1-CB 3.73Å; L97-K101 HydrophobicContact CD1-CG 3.76Å; L97-K101 HydrophobicContact CG-CB 4.33Å; L97-M102 HydrophobicContact CD2-CB 3.89Å; L97-L105 HydrophobicContact CD2-CD1 4.46Å; L97-I139 HydrophobicContact CD2-CG2 4.27Å
98	T	89.2	Confident	89.5	Confident	71 Å²	71	58 Å²	58	44%	0.436	30%	0.295	S	S	.	.			trans	-74.4	149.3	176.6	63.7	0	0	0	0	111.8	S100 K101 M102	T98-S100 PolarHBondContact O-N 2.81Å; T98-K101 PolarHBondContact O-N 3.4Å; T98-K101 PolarHBondContact OG1-N 3.4Å; T98-M102 PolarHBondContact O-N 3.3Å
99	L	87.4	Confident	90.1	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-52.8	-42.1	176	-178.4	63.7	0	0	0	112.2	L54 I84 F88 K101 M102 K103	L54-L99 HydrophobicContact CB-CD1 4.27Å; L54-L99 HydrophobicContact CB-CD2 3.73Å; I84-L99 HydrophobicContact CG2-CD2 3.32Å; F88-L99 HydrophobicContact CB-CB 4.32Å; F88-L99 HydrophobicContact CD2-CB 3.91Å; F88-L99 HydrophobicContact CD2-CD1 4.07Å; F88-L99 HydrophobicContact CD2-CG 4.44Å; F88-L99 HydrophobicContact CE2-CB 4.43Å; F88-L99 HydrophobicContact CE2-CD1 4.21Å; F88-L99 HydrophobicContact CG-CB 4.03Å; L99-K101 VanDerWaalsContact C-N 3.25Å; L99-K101 PolarHBondContact O-N 3.22Å; L99-M102 HydrophobicContact CD1-CE 3.23Å; L99-M102 PolarHBondContact O-N 3Å; L99-K103 HydrophobicContact CD1-CD 4.49Å; L99-K103 HydrophobicContact CD1-CG 4.49Å; L99-K103 HydrophobicContact CG-CD 4.33Å; L99-K103 WeakPolarHBondContact O-CG 3.45Å; L99-K103 PolarHBondContact O-N 2.88Å
100	S	88.4	Confident	90.6	Very high	46 Å²	46	51.8 Å²	51.8	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-58.5	-38.5	177	-62.8	0	0	0	0	112.1	T98 S104	T98-S100 PolarHBondContact O-N 2.81Å; S100-S104 PolarHBondContact O-N 3.48Å; S100-S104 VanDerWaalsContact O-N 3.12Å
101	K	91.9	Very high	91.2	Very high	62 Å²	62	51.7 Å²	51.7	27%	0.27	25%	0.253	S	S	.	.	H	α-helix	trans	-78.8	-36	-177.8	-161.2	66.5	-177.4	158.6	0	112.1	L97 T98 L99 S104 L105	L97-K101 HydrophobicContact CD1-CB 3.73Å; L97-K101 HydrophobicContact CD1-CG 3.76Å; L97-K101 HydrophobicContact CG-CB 4.33Å; T98-K101 PolarHBondContact O-N 3.4Å; T98-K101 PolarHBondContact OG1-N 3.4Å; L99-K101 VanDerWaalsContact C-N 3.25Å; L99-K101 PolarHBondContact O-N 3.22Å; K101-S104 WeakPolarHBondContact O-CB 3.42Å; K101-S104 PolarHBondContact O-N 2.98Å; K101-L105 WeakPolarHBondContact O-CG 3.44Å; K101-L105 PolarHBondContact O-N 3Å
102	M	93.3	Very high	91.7	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.02	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-49.7	169.9	-180	175.2	60.1	0	0	111.6	F51 F88 L97 T98 L99 S104 L105 K106 F130 I134	F51-M102 HydrophobicContact CB-CE 3.76Å; F51-M102 HydrophobicContact CD1-CE 3.55Å; F51-M102 HydrophobicContact CD1-SD 4.11Å; F51-M102 HydrophobicContact CD2-CE 4.42Å; F51-M102 HydrophobicContact CD2-SD 4.29Å; F51-M102 HydrophobicContact CE1-CE 4.19Å; F51-M102 HydrophobicContact CE1-SD 4.28Å; F51-M102 HydrophobicContact CE2-SD 4.45Å; F51-M102 HydrophobicContact CG-CE 3.65Å; F51-M102 HydrophobicContact CG-SD 4.08Å; F51-M102 HydrophobicContact CZ-SD 4.42Å; F88-M102 HydrophobicContact CE2-CE 4.08Å; L97-M102 HydrophobicContact CD2-CB 3.89Å; T98-M102 PolarHBondContact O-N 3.3Å; L99-M102 HydrophobicContact CD1-CE 3.23Å; L99-M102 PolarHBondContact O-N 3Å; M102-S104 VanDerWaalsContact C-N 3.31Å; M102-S104 PolarHBondContact O-N 3.39Å; M102-L105 PolarHBondContact O-N 3.44Å; M102-L105 VanDerWaalsContact O-N 3.17Å; M102-K106 PolarHBondContact O-N 2.96Å; M102-F130 HydrophobicContact CG-CE1 4.21Å; M102-I134 HydrophobicContact CG-CD1 3.81Å; M102-I134 HydrophobicContact SD-CD1 3.6Å; M102-I134 VanDerWaalsContact SD-CD1 3.6Å; M102-I134 HydrophobicContact SD-CG2 4.32Å
103	K	92.1	Very high	92.2	Very high	94 Å²	94	44.9 Å²	44.9	41%	0.409	22%	0.224	S	C	.	.	H	α-helix	trans	-60.5	-38.3	177	-70	-178.2	-179.8	-178.4	0	112.4	L54 L99 R107	L54-K103 PolarHBondContact O-NZ 3.06Å; L99-K103 HydrophobicContact CD1-CD 4.49Å; L99-K103 HydrophobicContact CD1-CG 4.49Å; L99-K103 HydrophobicContact CG-CD 4.33Å; L99-K103 WeakPolarHBondContact O-CG 3.45Å; L99-K103 PolarHBondContact O-N 2.88Å; K103-R107 PolarHBondContact O-N 2.72Å; K103-R107 VanDerWaalsContact O-N 3.08Å
104	S	94.5	Very high	92.6	Very high	21 Å²	21	44.8 Å²	44.8	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-46.8	173.7	-171.9	0	0	0	0	112.2	S100 K101 M102 R107 E108	S100-S104 PolarHBondContact O-N 3.48Å; S100-S104 VanDerWaalsContact O-N 3.12Å; K101-S104 WeakPolarHBondContact O-CB 3.42Å; K101-S104 PolarHBondContact O-N 2.98Å; M102-S104 VanDerWaalsContact C-N 3.31Å; M102-S104 PolarHBondContact O-N 3.39Å; S104-R107 PolarHBondContact O-N 3.34Å; S104-E108 WeakPolarHBondContact O-CG 3.23Å; S104-E108 PolarHBondContact O-N 3.49Å; S104-E108 PolarHBondContact OG-OE1 2.97Å; S104-E108 VanDerWaalsContact OG-OE1 3.09Å
105	L	96.5	Very high	93.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.1	-40.3	-179.1	-71.6	168.7	0	0	0	111.9	L97 K101 M102 R107 E108 M109 F130 R144 K145 A148	L97-L105 HydrophobicContact CD2-CD1 4.46Å; K101-L105 WeakPolarHBondContact O-CG 3.44Å; K101-L105 PolarHBondContact O-N 3Å; M102-L105 PolarHBondContact O-N 3.44Å; M102-L105 VanDerWaalsContact O-N 3.17Å; L105-R107 PolarHBondContact O-N 3.31Å; L105-E108 PolarHBondContact O-N 3.06Å; L105-M109 WeakPolarHBondContact O-CG 3Å; L105-M109 PolarHBondContact O-N 3.14Å; L105-F130 HydrophobicContact CB-CE1 4.22Å; L105-F130 HydrophobicContact CB-CZ 4.2Å; L105-F130 HydrophobicContact CD1-CZ 3.8Å; L105-R144 HydrophobicContact CD1-CB 3.95Å; L105-R144 HydrophobicContact CD1-CG 4.1Å; L105-K145 HydrophobicContact CD2-CG 3.96Å; L105-A148 HydrophobicContact CB-CB 4.44Å
106	K	95.9	Very high	93.4	Very high	22 Å²	22	42.5 Å²	42.5	10%	0.096	22%	0.218	C	C	.	.	H	α-helix	trans	-56.6	-49.5	172.1	-81.4	-169	147.6	-164.3	0	111.1	M102 E108 M109 A110 Y127 F130 E131 H209	M102-K106 PolarHBondContact O-N 2.96Å; K106-E108 VanDerWaalsContact C-N 3.35Å; K106-E108 PolarHBondContact O-N 2.7Å; K106-M109 WeakPolarHBondContact O-CA 3.47Å; K106-M109 WeakPolarHBondContact O-CB 3.5Å; K106-M109 PolarHBondContact O-N 3.5Å; K106-M109 VanDerWaalsContact O-N 3.08Å; K106-A110 PolarHBondContact O-N 2.83Å; K106-Y127 HydrophobicContact CB-CD1 4.46Å; K106-Y127 HydrophobicContact CB-CE1 3.79Å; K106-Y127 HydrophobicContact CB-CE2 4.17Å; K106-Y127 HydrophobicContact CD-CD1 4.37Å; K106-Y127 HydrophobicContact CD-CD2 3.94Å; K106-Y127 HydrophobicContact CD-CE1 4.41Å; K106-Y127 HydrophobicContact CD-CE2 3.98Å; K106-Y127 HydrophobicContact CD-CG 4.13Å; K106-Y127 VanDerWaalsContact CE-CG 3.42Å; K106-Y127 HydrophobicContact CG-CD1 4.01Å; K106-Y127 HydrophobicContact CG-CD2 4.4Å; K106-Y127 HydrophobicContact CG-CE1 3.84Å; K106-Y127 HydrophobicContact CG-CE2 4.25Å; K106-Y127 HydrophobicContact CG-CG 4.28Å; K106-Y127 WeakPolarHBondContact O-CE1 3.26Å; K106-Y127 PolarHBondContact O-OH 2.92Å; K106-F130 HydrophobicContact CG-CD1 4.38Å; K106-E131 WeakPolarHBondContact CE-OE1 2.99Å; K106-E131 IonicContact NZ-OE1 2.94Å; K106-E131 PolarHBondContact NZ-OE1 3.48Å; K106-E131 IonicContact NZ-OE2 3.29Å; K106-E131 PolarHBondContact NZ-OE2 3.41Å; K106-H209 PolarHBondContact NZ-CE1 2.77Å; K106-H209 PolarHBondContact NZ-ND1 3.3Å
107	R	95.7	Very high	93.8	Very high	139 Å²	139	39.5 Å²	39.5	53%	0.525	22%	0.222	S	C	.	.	H	α-helix	trans	-58.3	-44.1	176.2	-173.4	-179.1	58.2	-121	-10	112.7	K103 S104 L105 M109 A110 E111	K103-R107 PolarHBondContact O-N 2.72Å; K103-R107 VanDerWaalsContact O-N 3.08Å; S104-R107 PolarHBondContact O-N 3.34Å; L105-R107 PolarHBondContact O-N 3.31Å; R107-M109 VanDerWaalsContact C-N 3.32Å; R107-M109 PolarHBondContact O-N 3.39Å; R107-A110 PolarHBondContact O-N 2.74Å; R107-E111 HydrophobicContact CG-CG 4.5Å; R107-E111 WeakPolarHBondContact CG-OE1 3.32Å; R107-E111 IonicContact NE-OE1 2.59Å; R107-E111 WeakPolarHBondContact O-CG 3.43Å; R107-E111 PolarHBondContact O-N 3.13Å
108	E	96.5	Very high	94.2	Very high	27 Å²	27	39.5 Å²	39.5	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-43.4	174.6	-70.4	168.2	-122.2	0	0	111.1	S104 L105 K106 A110 E111 L112 Q176 L177	S104-E108 WeakPolarHBondContact O-CG 3.23Å; S104-E108 PolarHBondContact O-N 3.49Å; S104-E108 PolarHBondContact OG-OE1 2.97Å; S104-E108 VanDerWaalsContact OG-OE1 3.09Å; L105-E108 PolarHBondContact O-N 3.06Å; K106-E108 VanDerWaalsContact C-N 3.35Å; K106-E108 PolarHBondContact O-N 2.7Å; E108-A110 PolarHBondContact O-N 2.9Å; E108-E111 PolarHBondContact O-N 3.31Å; E108-L112 PolarHBondContact O-N 2.93Å; E108-Q176 PolarHBondContact O-OE1 2.97Å; E108-L177 HydrophobicContact CB-CD2 4.44Å
109	M	97.2	Very high	94.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-41.3	174.3	-67.5	168.2	71.2	0	0	113	L105 K106 R107 L112 G113 A126 Y127 F130 A148 A151 L152	L105-M109 WeakPolarHBondContact O-CG 3Å; L105-M109 PolarHBondContact O-N 3.14Å; K106-M109 WeakPolarHBondContact O-CA 3.47Å; K106-M109 WeakPolarHBondContact O-CB 3.5Å; K106-M109 PolarHBondContact O-N 3.5Å; K106-M109 VanDerWaalsContact O-N 3.08Å; R107-M109 VanDerWaalsContact C-N 3.32Å; R107-M109 PolarHBondContact O-N 3.39Å; M109-L112 PolarHBondContact O-N 3.38Å; M109-G113 PolarHBondContact O-N 3.38Å; M109-A126 HydrophobicContact CE-CB 3.6Å; M109-Y127 HydrophobicContact CB-CE1 4.01Å; M109-Y127 HydrophobicContact CE-CD1 4.04Å; M109-Y127 HydrophobicContact CE-CE1 4.45Å; M109-Y127 HydrophobicContact SD-CD1 4.3Å; M109-Y127 HydrophobicContact SD-CE1 4.34Å; M109-F130 HydrophobicContact SD-CD1 4.42Å; M109-F130 HydrophobicContact SD-CG 4.44Å; M109-A148 WeakPolarHBondContact CE-O 3.34Å; M109-A148 HydrophobicContact CG-CB 4.13Å; M109-A148 HydrophobicContact SD-CB 3.81Å; M109-A151 HydrophobicContact CE-CB 4.49Å; M109-L152 HydrophobicContact CB-CD2 4.35Å; M109-L152 HydrophobicContact CE-CB 4.11Å
110	A	96.6	Very high	94.9	Very high	9 Å²	9	40.6 Å²	40.6	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-40.7	175.8	0	0	0	0	0	112	K106 R107 E108 L112 G113 V114 V123 Y127 L213 M217	K106-A110 PolarHBondContact O-N 2.83Å; R107-A110 PolarHBondContact O-N 2.74Å; E108-A110 PolarHBondContact O-N 2.9Å; A110-L112 VanDerWaalsContact C-N 3.35Å; A110-L112 PolarHBondContact O-N 3.5Å; A110-G113 CarbonylContact O-C 3.58Å; A110-G113 VanDerWaalsContact O-CA 3.28Å; A110-G113 WeakPolarHBondContact O-CA 3.24Å; A110-G113 PolarHBondContact O-N 3.24Å; A110-V114 WeakPolarHBondContact O-CG2 3.18Å; A110-V114 PolarHBondContact O-N 2.89Å; A110-V123 HydrophobicContact CB-CG1 4.38Å; A110-Y127 WeakPolarHBondContact CB-OH 3.22Å; A110-L213 HydrophobicContact CB-CD2 4.02Å; A110-M217 HydrophobicContact CB-CG 4.24Å; A110-M217 HydrophobicContact CB-SD 4.41Å
111	E	96.5	Very high	95.3	Very high	82 Å²	82	43.5 Å²	43.5	38%	0.383	23%	0.231	S	C	.	.	H	α-helix	trans	-60.8	-40.7	174.9	-72	170.3	-161.9	0	0	111.9	R107 E108 G113 S115 Q176	R107-E111 HydrophobicContact CG-CG 4.5Å; R107-E111 WeakPolarHBondContact CG-OE1 3.32Å; R107-E111 IonicContact NE-OE1 2.59Å; R107-E111 WeakPolarHBondContact O-CG 3.43Å; R107-E111 PolarHBondContact O-N 3.13Å; E108-E111 PolarHBondContact O-N 3.31Å; E111-G113 VanDerWaalsContact C-N 3.31Å; E111-S115 WeakPolarHBondContact O-CB 3.37Å; E111-S115 PolarHBondContact O-N 3.07Å; E111-S115 PolarHBondContact O-OG 3.31Å; E111-Q176 PolarHBondContact OE2-NE2 3.18Å; E111-Q176 VanDerWaalsContact OE2-NE2 3.11Å
112	L	96.4	Very high	95.5	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-39.4	170.3	-72.5	166.7	0	0	0	111.8	E108 M109 A110 S115 N116 L152 Y169 Q172 A173 Q176 L177	E108-L112 PolarHBondContact O-N 2.93Å; M109-L112 PolarHBondContact O-N 3.38Å; A110-L112 VanDerWaalsContact C-N 3.35Å; A110-L112 PolarHBondContact O-N 3.5Å; L112-S115 PolarHBondContact O-N 3.45Å; L112-N116 PolarHBondContact O-N 3.15Å; L112-N116 VanDerWaalsContact O-N 3.13Å; L112-N116 PolarHBondContact O-ND2 3.06Å; L112-L152 HydrophobicContact CB-CD2 4.04Å; L112-Y169 HydrophobicContact CB-CD2 4.42Å; L112-Y169 HydrophobicContact CB-CE2 4.14Å; L112-Y169 HydrophobicContact CD1-CE2 3.95Å; L112-Y169 HydrophobicContact CG-CE2 4.45Å; L112-Q172 HydrophobicContact CD2-CB 4.03Å; L112-A173 HydrophobicContact CD1-CB 4.2Å; L112-A173 HydrophobicContact CD2-CB 4.49Å; L112-Q176 HydrophobicContact CD2-CB 4.19Å; L112-L177 HydrophobicContact CD1-CD1 4.43Å; L112-L177 HydrophobicContact CD1-CG 4.38Å
113	G	95.4	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-51.4	-59.4	173.6	0	0	0	0	0	111.8	M109 A110 E111 S115 N116 G117 I118	M109-G113 PolarHBondContact O-N 3.38Å; A110-G113 CarbonylContact O-C 3.58Å; A110-G113 VanDerWaalsContact O-CA 3.28Å; A110-G113 WeakPolarHBondContact O-CA 3.24Å; A110-G113 PolarHBondContact O-N 3.24Å; E111-G113 VanDerWaalsContact C-N 3.31Å; G113-S115 PolarHBondContact O-N 3.39Å; G113-N116 PolarHBondContact O-N 3.39Å; G113-G117 PolarHBondContact O-N 2.91Å; G113-I118 WeakPolarHBondContact O-CB 3.45Å; G113-I118 PolarHBondContact O-N 3.06Å
114	V	94.9	Very high	96	Very high	82 Å²	82	35.9 Å²	35.9	50%	0.497	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-46	179.7	176.9	0	0	0	0	111.1	A110 N116 G117 M217	A110-V114 WeakPolarHBondContact O-CG2 3.18Å; A110-V114 PolarHBondContact O-N 2.89Å; V114-N116 PolarHBondContact O-N 3.09Å; V114-G117 PolarHBondContact O-N 3.29Å; V114-M217 HydrophobicContact CG2-CB 3.99Å; V114-M217 HydrophobicContact CG2-CE 3.6Å; V114-M217 HydrophobicContact CG2-CG 3.92Å
115	S	94.4	Very high	96.1	Very high	74 Å²	74	35.5 Å²	35.5	52%	0.517	19%	0.194	S	C	.	.	H	α-helix	trans	-65.7	-25.5	-174.8	-58.1	0	0	0	0	113.8	E111 L112 G113 Q172	E111-S115 WeakPolarHBondContact O-CB 3.37Å; E111-S115 PolarHBondContact O-N 3.07Å; E111-S115 PolarHBondContact O-OG 3.31Å; L112-S115 PolarHBondContact O-N 3.45Å; G113-S115 PolarHBondContact O-N 3.39Å; S115-Q172 VanDerWaalsContact CB-OE1 3.27Å
116	N	94	Very high	96.2	Very high	19 Å²	19	35.5 Å²	35.5	10%	0.102	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	6.3	179.1	-67.5	-84.9	0	0	0	113.4	L112 G113 V114 I118 S168 Y169 Q172	L112-N116 PolarHBondContact O-N 3.15Å; L112-N116 VanDerWaalsContact O-N 3.13Å; L112-N116 PolarHBondContact O-ND2 3.06Å; G113-N116 PolarHBondContact O-N 3.39Å; V114-N116 PolarHBondContact O-N 3.09Å; N116-I118 VanDerWaalsContact C-N 3.28Å; N116-I118 HydrophobicContact CB-CD1 3.75Å; N116-I118 HydrophobicContact CB-CG1 3.98Å; N116-I118 PolarHBondContact O-N 2.9Å; N116-S168 WeakPolarHBondContact OD1-CB 3.27Å; N116-S168 PolarHBondContact OD1-OG 2.99Å; N116-Y169 WeakPolarHBondContact OD1-CA 3.46Å; N116-Y169 PolarHBondContact OD1-N 2.92Å; N116-Q172 PolarHBondContact ND2-OE1 2.82Å; N116-Q172 PolarHBondContact OD1-NE2 3.39Å
117	G	94.1	Very high	96.2	Very high	64 Å²	64	34.9 Å²	34.9	66%	0.66	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	34.2	-178.5	0	0	0	0	0	113.1	G113 V114	G113-G117 PolarHBondContact O-N 2.91Å; V114-G117 PolarHBondContact O-N 3.29Å
118	I	96.3	Very high	96.3	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.036	17%	0.166	C	C	.	.			trans	-80.9	134.5	176.7	-59.8	153.6	0	0	0	108.1	G113 N116 T122 V123 L156 Y161 Y169	G113-I118 WeakPolarHBondContact O-CB 3.45Å; G113-I118 PolarHBondContact O-N 3.06Å; N116-I118 VanDerWaalsContact C-N 3.28Å; N116-I118 HydrophobicContact CB-CD1 3.75Å; N116-I118 HydrophobicContact CB-CG1 3.98Å; N116-I118 PolarHBondContact O-N 2.9Å; I118-T122 HydrophobicContact CG2-CG2 3.67Å; I118-V123 HydrophobicContact CB-CG2 4.46Å; I118-V123 HydrophobicContact CG2-CG2 3.95Å; I118-L156 HydrophobicContact CD1-CD1 3.82Å; I118-L156 HydrophobicContact CD1-CD2 3.94Å; I118-L156 HydrophobicContact CD1-CG 4.24Å; I118-L156 HydrophobicContact CG1-CD1 4.28Å; I118-L156 HydrophobicContact CG1-CD2 4.18Å; I118-L156 HydrophobicContact CG1-CG 4.32Å; I118-L156 HydrophobicContact CG2-CD1 4.22Å; I118-Y161 WeakPolarHBondContact CA-OH 3.11Å; I118-Y161 HydrophobicContact CB-CE1 4.43Å; I118-Y161 HydrophobicContact CG1-CE1 4.23Å; I118-Y161 HydrophobicContact CG2-CE1 4.41Å; I118-Y161 HydrophobicContact CG2-CE2 4.5Å; I118-Y169 HydrophobicContact CD1-CD2 4.34Å
119	D	95.4	Very high	96.3	Very high	57 Å²	57	27 Å²	27	31%	0.305	16%	0.161	S	C	.	.			trans	-66	151.4	178.9	77.1	-93.7	0	0	0	112.4	Y121 T122 V123 N159 Y161	D119-Y121 PolarHBondContact O-N 3.33Å; D119-Y121 VanDerWaalsContact OD2-CA 3.3Å; D119-Y121 WeakPolarHBondContact OD2-CA 3.48Å; D119-Y121 WeakPolarHBondContact OD2-CB 3.21Å; D119-Y121 PolarHBondContact OD2-N 3.21Å; D119-T122 VanDerWaalsContact CG-OG1 3.29Å; D119-T122 PolarHBondContact O-N 3.35Å; D119-T122 WeakPolarHBondContact OD1-CB 3.4Å; D119-T122 PolarHBondContact OD1-OG1 3.38Å; D119-T122 PolarHBondContact OD2-N 3.48Å; D119-T122 PolarHBondContact OD2-OG1 3.17Å; D119-V123 PolarHBondContact O-N 3.29Å; D119-N159 PolarHBondContact OD1-ND2 3.21Å; D119-N159 VanDerWaalsContact OD1-ND2 3.12Å; D119-Y161 PolarHBondContact N-OH 2.74Å; D119-Y161 PolarHBondContact OD1-OH 2.99Å
120	V	96.4	Very high	96.3	Very high	40 Å²	40	27 Å²	27	24%	0.242	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-34.6	-177	177.5	0	0	0	0	112.2	V123 A124 V210 L213 Q214 M217	V120-V123 PolarHBondContact O-N 2.74Å; V120-A124 VanDerWaalsContact O-CB 3.31Å; V120-A124 WeakPolarHBondContact O-CB 3.5Å; V120-A124 PolarHBondContact O-N 2.87Å; V120-V210 HydrophobicContact CG1-CG1 4.19Å; V120-L213 HydrophobicContact CG1-CB 3.6Å; V120-L213 HydrophobicContact CG1-CD1 4.32Å; V120-Q214 HydrophobicContact CG1-CG 4.48Å; V120-M217 HydrophobicContact CG2-CE 4.34Å; V120-M217 HydrophobicContact CG2-SD 4.13Å
121	Y	96.4	Very high	96.3	Very high	107 Å²	107	26.8 Å²	26.8	42%	0.42	16%	0.158	S	C	.	.	H	α-helix	trans	-68.8	-37.9	-179.1	-179.4	-87.4	0	0	0	111.6	D119 A124 T125 I206 V210	D119-Y121 PolarHBondContact O-N 3.33Å; D119-Y121 VanDerWaalsContact OD2-CA 3.3Å; D119-Y121 WeakPolarHBondContact OD2-CA 3.48Å; D119-Y121 WeakPolarHBondContact OD2-CB 3.21Å; D119-Y121 PolarHBondContact OD2-N 3.21Å; Y121-A124 PolarHBondContact O-N 3.12Å; Y121-T125 WeakPolarHBondContact O-CB 3.42Å; Y121-T125 PolarHBondContact O-N 3.06Å; Y121-T125 PolarHBondContact O-OG1 2.85Å; Y121-I206 HydrophobicContact CD2-CG2 3.76Å; Y121-I206 HydrophobicContact CE1-CD1 4.33Å; Y121-I206 HydrophobicContact CE2-CB 4.34Å; Y121-I206 HydrophobicContact CE2-CD1 3.94Å; Y121-I206 HydrophobicContact CE2-CG2 3.62Å; Y121-I206 VanDerWaalsContact OH-CD1 3.27Å; Y121-I206 WeakPolarHBondContact OH-CD1 3.4Å; Y121-V210 HydrophobicContact CD2-CG2 4.31Å
122	T	97.5	Very high	96.2	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-65.7	-42.4	174	-61.7	0	0	0	0	111.8	I118 D119 T125 A126 A155 L156 N159 Y161	I118-T122 HydrophobicContact CG2-CG2 3.67Å; D119-T122 VanDerWaalsContact CG-OG1 3.29Å; D119-T122 PolarHBondContact O-N 3.35Å; D119-T122 WeakPolarHBondContact OD1-CB 3.4Å; D119-T122 PolarHBondContact OD1-OG1 3.38Å; D119-T122 PolarHBondContact OD2-N 3.48Å; D119-T122 PolarHBondContact OD2-OG1 3.17Å; T122-T125 WeakPolarHBondContact O-CB 3.46Å; T122-T125 PolarHBondContact O-N 3.45Å; T122-A126 PolarHBondContact O-N 3.26Å; T122-A155 HydrophobicContact CG2-CB 3.96Å; T122-L156 HydrophobicContact CG2-CD1 4.03Å; T122-L156 HydrophobicContact CG2-CG 4.42Å; T122-N159 PolarHBondContact OG1-ND2 2.9Å; T122-Y161 HydrophobicContact CG2-CE2 3.93Å; T122-Y161 WeakPolarHBondContact OG1-CE2 3.47Å
123	V	97.8	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-42.7	175.2	-179.4	0	0	0	0	110.8	A110 I118 D119 V120 T125 A126 Y127 L152 L213 M217	A110-V123 HydrophobicContact CB-CG1 4.38Å; I118-V123 HydrophobicContact CB-CG2 4.46Å; I118-V123 HydrophobicContact CG2-CG2 3.95Å; D119-V123 PolarHBondContact O-N 3.29Å; V120-V123 PolarHBondContact O-N 2.74Å; V123-T125 VanDerWaalsContact C-N 3.33Å; V123-T125 PolarHBondContact O-N 3.44Å; V123-A126 WeakPolarHBondContact O-CB 3.45Å; V123-A126 PolarHBondContact O-N 2.68Å; V123-Y127 HydrophobicContact CG1-CD1 4.46Å; V123-Y127 HydrophobicContact CG1-CE1 4.04Å; V123-Y127 PolarHBondContact O-N 3.06Å; V123-L152 HydrophobicContact CG2-CD1 4.49Å; V123-L213 HydrophobicContact CB-CD1 4.14Å; V123-L213 HydrophobicContact CG1-CD1 3.85Å; V123-L213 HydrophobicContact CG1-CD2 4.31Å; V123-M217 HydrophobicContact CB-SD 4.32Å; V123-M217 HydrophobicContact CG1-SD 4.29Å; V123-M217 HydrophobicContact CG2-CE 4.02Å; V123-M217 HydrophobicContact CG2-SD 4.27Å
124	A	97.3	Very high	96	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-40.7	175.3	0	0	0	0	0	112.2	V120 Y121 A126 Y127 V128 I206 H209 V210 L213	V120-A124 VanDerWaalsContact O-CB 3.31Å; V120-A124 WeakPolarHBondContact O-CB 3.5Å; V120-A124 PolarHBondContact O-N 2.87Å; Y121-A124 PolarHBondContact O-N 3.12Å; A124-A126 VanDerWaalsContact C-N 3.32Å; A124-A126 PolarHBondContact O-N 3.06Å; A124-Y127 WeakPolarHBondContact O-CB 3.4Å; A124-Y127 PolarHBondContact O-N 3.13Å; A124-V128 PolarHBondContact O-N 3.36Å; A124-V128 VanDerWaalsContact O-N 3.13Å; A124-I206 HydrophobicContact CB-CG2 3.84Å; A124-H209 HydrophobicContact CB-CB 3.87Å; A124-V210 HydrophobicContact CB-CG2 3.54Å; A124-L213 HydrophobicContact CB-CD1 3.94Å
125	T	97.4	Very high	95.8	Very high	12 Å²	12	23.5 Å²	23.5	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-42.7	174.7	-60.5	0	0	0	0	111.1	Y121 T122 V123 Y127 V128 Y129 A155 P201	Y121-T125 WeakPolarHBondContact O-CB 3.42Å; Y121-T125 PolarHBondContact O-N 3.06Å; Y121-T125 PolarHBondContact O-OG1 2.85Å; T122-T125 WeakPolarHBondContact O-CB 3.46Å; T122-T125 PolarHBondContact O-N 3.45Å; V123-T125 VanDerWaalsContact C-N 3.33Å; V123-T125 PolarHBondContact O-N 3.44Å; T125-Y127 VanDerWaalsContact C-N 3.32Å; T125-Y127 PolarHBondContact O-N 3.23Å; T125-V128 PolarHBondContact O-N 3.11Å; T125-Y129 HydrophobicContact CG2-CE1 4.07Å; T125-Y129 HydrophobicContact CG2-CE2 3.76Å; T125-Y129 VanDerWaalsContact CG2-CZ 3.45Å; T125-Y129 VanDerWaalsContact CG2-OH 3.26Å; T125-Y129 WeakPolarHBondContact CG2-OH 3.3Å; T125-Y129 PolarHBondContact O-N 2.98Å; T125-Y129 VanDerWaalsContact O-N 3.14Å; T125-A155 HydrophobicContact CG2-CB 4.29Å; T125-P201 HydrophobicContact CG2-CG 4.17Å
126	A	97.8	Very high	95.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-36.7	175	0	0	0	0	0	112.9	M109 T122 V123 A124 V128 Y129 F130 L152 A155	M109-A126 HydrophobicContact CE-CB 3.6Å; T122-A126 PolarHBondContact O-N 3.26Å; V123-A126 WeakPolarHBondContact O-CB 3.45Å; V123-A126 PolarHBondContact O-N 2.68Å; A124-A126 VanDerWaalsContact C-N 3.32Å; A124-A126 PolarHBondContact O-N 3.06Å; A126-V128 VanDerWaalsContact C-N 3.33Å; A126-V128 PolarHBondContact O-N 3.41Å; A126-Y129 PolarHBondContact O-N 3.39Å; A126-F130 WeakPolarHBondContact O-CB 3.49Å; A126-F130 PolarHBondContact O-N 3.16Å; A126-L152 HydrophobicContact CB-CB 4.02Å; A126-L152 HydrophobicContact CB-CD1 3.67Å; A126-L152 HydrophobicContact CB-CG 4.46Å; A126-A155 HydrophobicContact CB-CB 3.86Å
127	Y	97.1	Very high	95.4	Very high	9 Å²	9	23.8 Å²	23.8	4%	0.035	13%	0.13	C	C	.	.	H	α-helix	trans	-60.5	-42.5	173.5	-79.5	9.7	0	0	0	111.9	K106 M109 A110 V123 A124 T125 F130 E131 H209 L213	K106-Y127 HydrophobicContact CB-CD1 4.46Å; K106-Y127 HydrophobicContact CB-CE1 3.79Å; K106-Y127 HydrophobicContact CB-CE2 4.17Å; K106-Y127 HydrophobicContact CD-CD1 4.37Å; K106-Y127 HydrophobicContact CD-CD2 3.94Å; K106-Y127 HydrophobicContact CD-CE1 4.41Å; K106-Y127 HydrophobicContact CD-CE2 3.98Å; K106-Y127 HydrophobicContact CD-CG 4.13Å; K106-Y127 VanDerWaalsContact CE-CG 3.42Å; K106-Y127 HydrophobicContact CG-CD1 4.01Å; K106-Y127 HydrophobicContact CG-CD2 4.4Å; K106-Y127 HydrophobicContact CG-CE1 3.84Å; K106-Y127 HydrophobicContact CG-CE2 4.25Å; K106-Y127 HydrophobicContact CG-CG 4.28Å; K106-Y127 WeakPolarHBondContact O-CE1 3.26Å; K106-Y127 PolarHBondContact O-OH 2.92Å; M109-Y127 HydrophobicContact CB-CE1 4.01Å; M109-Y127 HydrophobicContact CE-CD1 4.04Å; M109-Y127 HydrophobicContact CE-CE1 4.45Å; M109-Y127 HydrophobicContact SD-CD1 4.3Å; M109-Y127 HydrophobicContact SD-CE1 4.34Å; A110-Y127 WeakPolarHBondContact CB-OH 3.22Å; V123-Y127 HydrophobicContact CG1-CD1 4.46Å; V123-Y127 HydrophobicContact CG1-CE1 4.04Å; V123-Y127 PolarHBondContact O-N 3.06Å; A124-Y127 WeakPolarHBondContact O-CB 3.4Å; A124-Y127 PolarHBondContact O-N 3.13Å; T125-Y127 VanDerWaalsContact C-N 3.32Å; T125-Y127 PolarHBondContact O-N 3.23Å; Y127-F130 PolarHBondContact O-N 3.42Å; Y127-E131 WeakPolarHBondContact O-CB 3.32Å; Y127-E131 WeakPolarHBondContact O-CG 3.24Å; Y127-E131 PolarHBondContact O-N 2.93Å; Y127-H209 HydrophobicContact CD2-CB 4.35Å; Y127-L213 HydrophobicContact CD2-CD1 4.12Å; Y127-L213 HydrophobicContact CE2-CD1 3.91Å; Y127-L213 HydrophobicContact CE2-CD2 3.67Å; Y127-L213 HydrophobicContact CE2-CG 3.93Å
128	V	96.9	Very high	95.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.1	-45	177.1	175.9	0	0	0	0	110.9	Y46 A124 T125 A126 F130 E131 K132 P201 E205 I206	Y46-V128 HydrophobicContact CD1-CG1 4.17Å; Y46-V128 HydrophobicContact CE1-CB 4.35Å; Y46-V128 HydrophobicContact CE1-CG1 3.66Å; Y46-V128 HydrophobicContact CE1-CG2 4.11Å; A124-V128 PolarHBondContact O-N 3.36Å; A124-V128 VanDerWaalsContact O-N 3.13Å; T125-V128 PolarHBondContact O-N 3.11Å; A126-V128 VanDerWaalsContact C-N 3.33Å; A126-V128 PolarHBondContact O-N 3.41Å; V128-F130 PolarHBondContact O-N 2.93Å; V128-E131 PolarHBondContact O-N 3.23Å; V128-K132 HydrophobicContact CG1-CD 3.93Å; V128-K132 HydrophobicContact CG1-CG 4.33Å; V128-K132 WeakPolarHBondContact O-CB 3.42Å; V128-K132 VanDerWaalsContact O-CG 3.3Å; V128-K132 WeakPolarHBondContact O-CG 3.33Å; V128-K132 PolarHBondContact O-N 3.47Å; V128-P201 HydrophobicContact CB-CB 4.47Å; V128-P201 HydrophobicContact CB-CG 4.26Å; V128-P201 HydrophobicContact CG1-CB 3.86Å; V128-P201 HydrophobicContact CG1-CG 3.9Å; V128-E205 HydrophobicContact CG1-CB 4.48Å; V128-E205 WeakPolarHBondContact CG2-O 3.36Å; V128-I206 HydrophobicContact CG2-CG1 4.23Å
129	Y	97.3	Very high	95.1	Very high	2 Å²	2	22 Å²	22	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-58.7	-48.5	175.6	-63.1	-20.1	0	0	0	112	T125 A126 E131 K132 I133 V154 A155 L195 L199 P201	T125-Y129 HydrophobicContact CG2-CE1 4.07Å; T125-Y129 HydrophobicContact CG2-CE2 3.76Å; T125-Y129 VanDerWaalsContact CG2-CZ 3.45Å; T125-Y129 VanDerWaalsContact CG2-OH 3.26Å; T125-Y129 WeakPolarHBondContact CG2-OH 3.3Å; T125-Y129 PolarHBondContact O-N 2.98Å; T125-Y129 VanDerWaalsContact O-N 3.14Å; A126-Y129 PolarHBondContact O-N 3.39Å; Y129-E131 PolarHBondContact O-N 3.27Å; Y129-K132 PolarHBondContact O-N 2.69Å; Y129-I133 WeakPolarHBondContact O-CD1 3.48Å; Y129-I133 VanDerWaalsContact O-CG1 3.24Å; Y129-I133 WeakPolarHBondContact O-CG1 3.46Å; Y129-I133 PolarHBondContact O-N 2.9Å; Y129-I133 VanDerWaalsContact O-N 3.16Å; Y129-V154 HydrophobicContact CD2-CG1 4.48Å; Y129-V154 HydrophobicContact CE2-CG1 4.12Å; Y129-A155 HydrophobicContact CD2-CB 4.33Å; Y129-A155 HydrophobicContact CE2-CB 3.93Å; Y129-L195 HydrophobicContact CD1-CD1 3.68Å; Y129-L195 HydrophobicContact CD2-CD1 4.45Å; Y129-L195 HydrophobicContact CE1-CD1 4.37Å; Y129-L195 HydrophobicContact CG-CD1 3.74Å; Y129-L199 HydrophobicContact CE1-CD2 4.42Å; Y129-L199 PolarHBondContact OH-O 3.47Å; Y129-P201 HydrophobicContact CD1-CG 4.27Å; Y129-P201 HydrophobicContact CE1-CG 3.59Å
130	F	96.8	Very high	94.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-46.4	-180	-175.6	-123.2	0	0	0	111.7	M102 L105 K106 M109 A126 Y127 V128 I133 I134 I139 V147 A148 A151	M102-F130 HydrophobicContact CG-CE1 4.21Å; L105-F130 HydrophobicContact CB-CE1 4.22Å; L105-F130 HydrophobicContact CB-CZ 4.2Å; L105-F130 HydrophobicContact CD1-CZ 3.8Å; K106-F130 HydrophobicContact CG-CD1 4.38Å; M109-F130 HydrophobicContact SD-CD1 4.42Å; M109-F130 HydrophobicContact SD-CG 4.44Å; A126-F130 WeakPolarHBondContact O-CB 3.49Å; A126-F130 PolarHBondContact O-N 3.16Å; Y127-F130 PolarHBondContact O-N 3.42Å; V128-F130 PolarHBondContact O-N 2.93Å; F130-I133 PolarHBondContact O-N 3.34Å; F130-I134 HydrophobicContact CD1-CD1 3.53Å; F130-I134 HydrophobicContact CD2-CD1 4.3Å; F130-I134 HydrophobicContact CE1-CD1 3.33Å; F130-I134 HydrophobicContact CE1-CG1 4.41Å; F130-I134 HydrophobicContact CE2-CD1 4.13Å; F130-I134 HydrophobicContact CE2-CG1 4.43Å; F130-I134 HydrophobicContact CG-CD1 4.02Å; F130-I134 HydrophobicContact CZ-CD1 3.64Å; F130-I134 HydrophobicContact CZ-CG1 4.29Å; F130-I134 WeakPolarHBondContact O-CD1 3.3Å; F130-I134 VanDerWaalsContact O-CG1 3.29Å; F130-I134 WeakPolarHBondContact O-CG1 3.45Å; F130-I134 PolarHBondContact O-N 3.43Å; F130-I139 HydrophobicContact CD2-CD1 3.95Å; F130-I139 HydrophobicContact CE2-CD1 3.39Å; F130-I139 HydrophobicContact CZ-CD1 4.06Å; F130-V147 HydrophobicContact CD2-CG1 4.07Å; F130-V147 HydrophobicContact CE2-CG1 4.27Å; F130-A148 HydrophobicContact CD2-CB 4.13Å; F130-A148 HydrophobicContact CE2-CB 3.84Å; F130-A148 HydrophobicContact CZ-CB 4.21Å; F130-A151 HydrophobicContact CB-CB 4.37Å
131	E	95.1	Very high	94.7	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-67.7	-38.1	-179.8	-74.1	-172.4	154.6	0	0	113	Y46 F51 K106 Y127 V128 Y129 I133 I134 L135 H209	Y46-E131 HydrophobicContact CE2-CB 3.71Å; Y46-E131 PolarHBondContact OH-OE2 3.07Å; F51-E131 HydrophobicContact CD2-CB 4.19Å; F51-E131 VanDerWaalsContact CD2-CD 3.43Å; F51-E131 HydrophobicContact CD2-CG 3.82Å; F51-E131 VanDerWaalsContact CD2-OE1 3.32Å; F51-E131 WeakPolarHBondContact CD2-OE1 3.42Å; F51-E131 HydrophobicContact CE2-CB 3.86Å; F51-E131 HydrophobicContact CE2-CG 3.91Å; K106-E131 WeakPolarHBondContact CE-OE1 2.99Å; K106-E131 IonicContact NZ-OE1 2.94Å; K106-E131 PolarHBondContact NZ-OE1 3.48Å; K106-E131 IonicContact NZ-OE2 3.29Å; K106-E131 PolarHBondContact NZ-OE2 3.41Å; Y127-E131 WeakPolarHBondContact O-CB 3.32Å; Y127-E131 WeakPolarHBondContact O-CG 3.24Å; Y127-E131 PolarHBondContact O-N 2.93Å; V128-E131 PolarHBondContact O-N 3.23Å; Y129-E131 PolarHBondContact O-N 3.27Å; E131-I133 VanDerWaalsContact C-N 3.29Å; E131-I133 PolarHBondContact O-N 2.98Å; E131-I134 WeakPolarHBondContact O-CB 3.37Å; E131-I134 PolarHBondContact O-N 3.18Å; E131-L135 WeakPolarHBondContact O-CG 3.29Å; E131-L135 PolarHBondContact O-N 2.99Å; E131-H209 IonicContact OE2-CE1 3.06Å; E131-H209 PolarHBondContact OE2-CE1 3.41Å; E131-H209 IonicContact OE2-NE2 2.68Å; E131-H209 PolarHBondContact OE2-NE2 3.21Å
132	K	94.6	Very high	94.4	Very high	42 Å²	42	26.9 Å²	26.9	18%	0.183	14%	0.136	C	C	.	.	H	α-helix	trans	-59.7	-39	172.9	-76.3	179.9	176.6	-176.1	0	112	Y46 V128 Y129 K136 L195 E205	Y46-K132 HydrophobicContact CD1-CG 4.5Å; Y46-K132 HydrophobicContact CD2-CG 3.87Å; Y46-K132 HydrophobicContact CE2-CG 4.35Å; Y46-K132 HydrophobicContact CG-CD 4.49Å; Y46-K132 HydrophobicContact CG-CG 3.93Å; V128-K132 HydrophobicContact CG1-CD 3.93Å; V128-K132 HydrophobicContact CG1-CG 4.33Å; V128-K132 WeakPolarHBondContact O-CB 3.42Å; V128-K132 VanDerWaalsContact O-CG 3.3Å; V128-K132 WeakPolarHBondContact O-CG 3.33Å; V128-K132 PolarHBondContact O-N 3.47Å; Y129-K132 PolarHBondContact O-N 2.69Å; K132-K136 WeakPolarHBondContact O-CG 3.39Å; K132-K136 PolarHBondContact O-N 3.49Å; K132-L195 HydrophobicContact CB-CD2 3.85Å; K132-L195 HydrophobicContact CD-CD2 4.34Å; K132-E205 WeakPolarHBondContact CE-OE1 3.43Å; K132-E205 VanDerWaalsContact NZ-CD 3.35Å; K132-E205 IonicContact NZ-OE1 3.23Å; K132-E205 PolarHBondContact NZ-OE1 3.4Å; K132-E205 IonicContact NZ-OE2 3.86Å; K132-E205 PolarHBondContact NZ-OE2 3.08Å
133	I	94.3	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-71.7	-39	177.1	-60.8	159	0	0	0	111.2	I6 Y129 F130 E131 L135 K136 L138 I139 V147 I191 V194 L195	I6-I133 HydrophobicContact CD1-CG2 3.85Å; Y129-I133 WeakPolarHBondContact O-CD1 3.48Å; Y129-I133 VanDerWaalsContact O-CG1 3.24Å; Y129-I133 WeakPolarHBondContact O-CG1 3.46Å; Y129-I133 PolarHBondContact O-N 2.9Å; Y129-I133 VanDerWaalsContact O-N 3.16Å; F130-I133 PolarHBondContact O-N 3.34Å; E131-I133 VanDerWaalsContact C-N 3.29Å; E131-I133 PolarHBondContact O-N 2.98Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 3.35Å; I133-K136 PolarHBondContact O-N 3.14Å; I133-L138 HydrophobicContact CG2-CB 4.22Å; I133-I139 HydrophobicContact CG2-CD1 4.19Å; I133-I139 HydrophobicContact CG2-CG1 3.9Å; I133-V147 HydrophobicContact CB-CG1 4.48Å; I133-V147 HydrophobicContact CD1-CG1 3.79Å; I133-V147 HydrophobicContact CG2-CG1 4.04Å; I133-I191 HydrophobicContact CD1-CB 4.35Å; I133-I191 HydrophobicContact CD1-CD1 4.39Å; I133-I191 HydrophobicContact CD1-CG1 4Å; I133-I191 HydrophobicContact CD1-CG2 3.71Å; I133-V194 HydrophobicContact CG1-CG1 4Å; I133-V194 HydrophobicContact CG2-CG1 4.49Å; I133-L195 HydrophobicContact CG1-CD2 4.24Å
134	I	93.6	Very high	94.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58	-48.2	174.5	-73.2	162	0	0	0	110.5	F51 I95 M102 F130 E131 K136 G137 I139	F51-I134 HydrophobicContact CE1-CG2 4.43Å; F51-I134 HydrophobicContact CZ-CG2 3.86Å; I95-I134 HydrophobicContact CD1-CG2 3.61Å; I95-I134 HydrophobicContact CG1-CG2 4.13Å; I95-I134 WeakPolarHBondContact CG1-O 3.36Å; I95-I134 HydrophobicContact CG2-CG2 3.89Å; M102-I134 HydrophobicContact CG-CD1 3.81Å; M102-I134 HydrophobicContact SD-CD1 3.6Å; M102-I134 VanDerWaalsContact SD-CD1 3.6Å; M102-I134 HydrophobicContact SD-CG2 4.32Å; F130-I134 HydrophobicContact CD1-CD1 3.53Å; F130-I134 HydrophobicContact CD2-CD1 4.3Å; F130-I134 HydrophobicContact CE1-CD1 3.33Å; F130-I134 HydrophobicContact CE1-CG1 4.41Å; F130-I134 HydrophobicContact CE2-CD1 4.13Å; F130-I134 HydrophobicContact CE2-CG1 4.43Å; F130-I134 HydrophobicContact CG-CD1 4.02Å; F130-I134 HydrophobicContact CZ-CD1 3.64Å; F130-I134 HydrophobicContact CZ-CG1 4.29Å; F130-I134 WeakPolarHBondContact O-CD1 3.3Å; F130-I134 VanDerWaalsContact O-CG1 3.29Å; F130-I134 WeakPolarHBondContact O-CG1 3.45Å; F130-I134 PolarHBondContact O-N 3.43Å; E131-I134 WeakPolarHBondContact O-CB 3.37Å; E131-I134 PolarHBondContact O-N 3.18Å; I134-K136 PolarHBondContact O-N 3.46Å; I134-G137 PolarHBondContact O-N 3.01Å; I134-I139 HydrophobicContact CB-CD1 4.45Å; I134-I139 HydrophobicContact CD1-CD1 4.29Å; I134-I139 HydrophobicContact CG1-CD1 3.36Å; I134-I139 HydrophobicContact CG1-CG1 4.02Å
135	L	91.4	Very high	94.1	Very high	57 Å²	57	31 Å²	31	30%	0.298	15%	0.153	S	C	.	.	H	α-helix	trans	-61.6	-28.2	-179.8	-72.7	168.5	0	0	0	113.1	Y46 F51 Y92 E131 I133 G137	Y46-L135 HydrophobicContact CD2-CD1 3.58Å; Y46-L135 HydrophobicContact CE2-CD1 4.18Å; F51-L135 HydrophobicContact CE1-CD2 4.28Å; F51-L135 HydrophobicContact CE2-CD1 4.32Å; F51-L135 HydrophobicContact CE2-CD2 4.05Å; F51-L135 HydrophobicContact CE2-CG 3.96Å; F51-L135 HydrophobicContact CZ-CD2 3.47Å; F51-L135 VanDerWaalsContact CZ-CD2 3.47Å; F51-L135 HydrophobicContact CZ-CG 3.74Å; Y92-L135 HydrophobicContact CD1-CD2 4.23Å; Y92-L135 HydrophobicContact CE1-CD2 3.79Å; E131-L135 WeakPolarHBondContact O-CG 3.29Å; E131-L135 PolarHBondContact O-N 2.99Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 3.35Å; L135-G137 PolarHBondContact O-N 3.21Å
136	K	90.8	Very high	94	Very high	94 Å²	94	30.7 Å²	30.7	41%	0.409	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5	173.4	-67.3	-177.8	179.8	-159.3	0	113.7	K132 I133 I134 L138 V194	K132-K136 WeakPolarHBondContact O-CG 3.39Å; K132-K136 PolarHBondContact O-N 3.49Å; I133-K136 PolarHBondContact O-N 3.14Å; I134-K136 PolarHBondContact O-N 3.46Å; K136-L138 VanDerWaalsContact C-N 3.27Å; K136-L138 HydrophobicContact CB-CD1 3.79Å; K136-L138 HydrophobicContact CB-CG 3.74Å; K136-L138 HydrophobicContact CD-CD1 4.26Å; K136-L138 PolarHBondContact O-N 2.83Å; K136-V194 HydrophobicContact CD-CG1 3.9Å; K136-V194 PolarHBondContact NZ-O 3.19Å
137	G	89.8	Confident	94	Very high	4 Å²	4	30.7 Å²	30.7	4%	0.041	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	14.5	179.1	0	0	0	0	0	114.5	M94 I134 L135 I139	M94-G137 WeakPolarHBondContact O-CA 3.46Å; I134-G137 PolarHBondContact O-N 3.01Å; L135-G137 PolarHBondContact O-N 3.21Å; G137-I139 VanDerWaalsContact C-N 3.29Å; G137-I139 PolarHBondContact O-N 3.32Å
138	L	90.6	Very high	94	Very high	30 Å²	30	30.2 Å²	30.2	16%	0.157	15%	0.149	C	C	.	.			trans	-89.6	8.4	-171.7	-48.4	173	0	0	0	113.5	E4 I6 I133 K136 N143 V194	E4-L138 WeakPolarHBondContact O-CD2 3.26Å; I6-L138 HydrophobicContact CD1-CB 4.29Å; I6-L138 HydrophobicContact CG1-CB 3.94Å; I6-L138 HydrophobicContact CG1-CD1 4.45Å; I133-L138 HydrophobicContact CG2-CB 4.22Å; K136-L138 VanDerWaalsContact C-N 3.27Å; K136-L138 HydrophobicContact CB-CD1 3.79Å; K136-L138 HydrophobicContact CB-CG 3.74Å; K136-L138 HydrophobicContact CD-CD1 4.26Å; K136-L138 PolarHBondContact O-N 2.83Å; L138-N143 PolarHBondContact O-ND2 3Å; L138-V194 HydrophobicContact CD1-CB 4.35Å; L138-V194 HydrophobicContact CD1-CG1 3.47Å; L138-V194 VanDerWaalsContact CD1-CG1 3.47Å; L138-V194 HydrophobicContact CD1-CG2 3.85Å
139	I	92.9	Very high	94.1	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	15%	0.149	C	C	.	.			trans	-102.3	130.2	-178	-59.4	-148.3	0	0	0	111.3	L97 F130 I133 I134 G137 N143 R144 V147	L97-I139 HydrophobicContact CD2-CG2 4.27Å; F130-I139 HydrophobicContact CD2-CD1 3.95Å; F130-I139 HydrophobicContact CE2-CD1 3.39Å; F130-I139 HydrophobicContact CZ-CD1 4.06Å; I133-I139 HydrophobicContact CG2-CD1 4.19Å; I133-I139 HydrophobicContact CG2-CG1 3.9Å; I134-I139 HydrophobicContact CB-CD1 4.45Å; I134-I139 HydrophobicContact CD1-CD1 4.29Å; I134-I139 HydrophobicContact CG1-CD1 3.36Å; I134-I139 HydrophobicContact CG1-CG1 4.02Å; G137-I139 VanDerWaalsContact C-N 3.29Å; G137-I139 PolarHBondContact O-N 3.32Å; I139-N143 WeakPolarHBondContact CA-OD1 3.39Å; I139-R144 HydrophobicContact CG2-CB 3.45Å; I139-R144 VanDerWaalsContact CG2-CB 3.45Å; I139-V147 HydrophobicContact CD1-CB 4.4Å; I139-V147 HydrophobicContact CD1-CG1 3.89Å
140	S	92	Very high	94.1	Very high	28 Å²	28	30.1 Å²	30.1	20%	0.196	15%	0.148	C	C	.	.			trans	-123.8	171.3	177	77.3	0	0	0	0	111.6	V142 N143 R144	S140-V142 PolarHBondContact O-N 2.91Å; S140-V142 PolarHBondContact OG-N 3.03Å; S140-N143 PolarHBondContact N-OD1 3.39Å; S140-N143 PolarHBondContact O-N 3.17Å; S140-N143 PolarHBondContact O-OD1 3.22Å; S140-N143 PolarHBondContact OG-N 3.36Å; S140-N143 PolarHBondContact OG-OD1 2.5Å; S140-R144 VanDerWaalsContact O-CB 3.23Å; S140-R144 WeakPolarHBondContact O-CB 3.5Å; S140-R144 WeakPolarHBondContact O-CG 3.29Å; S140-R144 PolarHBondContact O-N 3.12Å; S140-R144 VanDerWaalsContact O-N 3.09Å
141	K	90.4	Very high	94.2	Very high	163 Å²	163	30.1 Å²	30.1	71%	0.709	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-32.1	175.1	-177	178.7	175.2	-173.9	0	112.8	R144	K141-R144 PolarHBondContact O-NE 3.21Å
142	V	90.9	Very high	94.3	Very high	116 Å²	116	30 Å²	30	70%	0.703	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-46.7	-174.7	-177.9	0	0	0	0	110.7	S140	S140-V142 PolarHBondContact O-N 2.91Å; S140-V142 PolarHBondContact OG-N 3.03Å
143	N	94.2	Very high	94.5	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.6	-171.6	71.7	6	0	0	0	114.5	T5 L138 I139 S140 K145 C146 V147 Y187	T5-N143 WeakPolarHBondContact CG2-ND2 3.44Å; L138-N143 PolarHBondContact O-ND2 3Å; I139-N143 WeakPolarHBondContact CA-OD1 3.39Å; S140-N143 PolarHBondContact N-OD1 3.39Å; S140-N143 PolarHBondContact O-N 3.17Å; S140-N143 PolarHBondContact O-OD1 3.22Å; S140-N143 PolarHBondContact OG-N 3.36Å; S140-N143 PolarHBondContact OG-OD1 2.5Å; N143-K145 PolarHBondContact O-N 2.59Å; N143-C146 PolarHBondContact O-N 3.03Å; N143-V147 HydrophobicContact CB-CG2 4.16Å; N143-V147 WeakPolarHBondContact O-CG2 3.4Å; N143-V147 PolarHBondContact O-N 3.37Å; N143-Y187 HydrophobicContact CB-CE1 3.79Å; N143-Y187 VanDerWaalsContact CB-OH 3.23Å; N143-Y187 WeakPolarHBondContact CB-OH 3.44Å
144	R	95.2	Very high	94.6	Very high	46 Å²	46	28.2 Å²	28.2	17%	0.174	14%	0.14	C	C	.	.	H	α-helix	trans	-52.3	-32	-169.8	61.5	-171.1	176.3	-171.9	3.4	115.4	L105 I139 S140 K141 A148	L105-R144 HydrophobicContact CD1-CB 3.95Å; L105-R144 HydrophobicContact CD1-CG 4.1Å; I139-R144 HydrophobicContact CG2-CB 3.45Å; I139-R144 VanDerWaalsContact CG2-CB 3.45Å; S140-R144 VanDerWaalsContact O-CB 3.23Å; S140-R144 WeakPolarHBondContact O-CB 3.5Å; S140-R144 WeakPolarHBondContact O-CG 3.29Å; S140-R144 PolarHBondContact O-N 3.12Å; S140-R144 VanDerWaalsContact O-N 3.09Å; K141-R144 PolarHBondContact O-NE 3.21Å; R144-A148 WeakPolarHBondContact O-CB 3.41Å; R144-A148 PolarHBondContact O-N 2.85Å; R144-A148 VanDerWaalsContact O-N 3.17Å
145	K	96.6	Very high	94.8	Very high	41 Å²	41	28.3 Å²	28.3	18%	0.178	14%	0.141	C	C	.	.	H	α-helix	trans	-79.5	-47.6	178.9	-68.1	-161.3	-174.5	171.9	0	111.8	L105 N143 V147 A148 G149 L177 E179	L105-K145 HydrophobicContact CD2-CG 3.96Å; N143-K145 PolarHBondContact O-N 2.59Å; K145-V147 PolarHBondContact O-N 3.33Å; K145-A148 PolarHBondContact O-N 3.34Å; K145-G149 PolarHBondContact O-N 3.45Å; K145-L177 WeakPolarHBondContact CD-O 3.46Å; K145-L177 WeakPolarHBondContact CE-O 3.47Å; K145-L177 PolarHBondContact NZ-O 2.82Å; K145-E179 HydrophobicContact CB-CG 3.6Å; K145-E179 HydrophobicContact CD-CG 4.12Å; K145-E179 WeakPolarHBondContact CD-OE1 3.3Å
146	C	96.6	Very high	95.1	Very high	4 Å²	4	25.6 Å²	25.6	3%	0.027	13%	0.127	C	C	.	.	H	α-helix	trans	-58	-40.7	173.4	-58.8	0	0	0	0	111	N143 G149 A150 Y187	N143-C146 PolarHBondContact O-N 3.03Å; C146-G149 PolarHBondContact O-N 3.28Å; C146-A150 WeakPolarHBondContact O-CB 3.43Å; C146-A150 PolarHBondContact O-N 2.98Å; C146-Y187 HydrophobicContact CB-CD2 3.48Å; C146-Y187 VanDerWaalsContact CB-CD2 3.48Å; C146-Y187 HydrophobicContact CB-CE2 3.77Å; C146-Y187 HydrophobicContact CB-CG 3.99Å
147	V	97.1	Very high	95.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.2	-44.8	177.2	177.1	0	0	0	0	111.8	I6 F130 I133 I139 N143 K145 A151 Y187 I191	I6-V147 HydrophobicContact CD1-CG2 3.97Å; F130-V147 HydrophobicContact CD2-CG1 4.07Å; F130-V147 HydrophobicContact CE2-CG1 4.27Å; I133-V147 HydrophobicContact CB-CG1 4.48Å; I133-V147 HydrophobicContact CD1-CG1 3.79Å; I133-V147 HydrophobicContact CG2-CG1 4.04Å; I139-V147 HydrophobicContact CD1-CB 4.4Å; I139-V147 HydrophobicContact CD1-CG1 3.89Å; N143-V147 HydrophobicContact CB-CG2 4.16Å; N143-V147 WeakPolarHBondContact O-CG2 3.4Å; N143-V147 PolarHBondContact O-N 3.37Å; K145-V147 PolarHBondContact O-N 3.33Å; V147-A151 VanDerWaalsContact O-CB 3.22Å; V147-A151 WeakPolarHBondContact O-CB 3.42Å; V147-A151 PolarHBondContact O-N 3.12Å; V147-Y187 HydrophobicContact CG2-CD1 3.84Å; V147-Y187 HydrophobicContact CG2-CE1 4.01Å; V147-I191 HydrophobicContact CB-CD1 4.36Å; V147-I191 HydrophobicContact CG1-CD1 4.01Å; V147-I191 HydrophobicContact CG1-CG1 4.44Å; V147-I191 WeakPolarHBondContact O-CD1 3.46Å
148	A	97.6	Very high	95.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.6	-46.6	176.7	0	0	0	0	0	112	L105 M109 F130 R144 K145 L152	L105-A148 HydrophobicContact CB-CB 4.44Å; M109-A148 WeakPolarHBondContact CE-O 3.34Å; M109-A148 HydrophobicContact CG-CB 4.13Å; M109-A148 HydrophobicContact SD-CB 3.81Å; F130-A148 HydrophobicContact CD2-CB 4.13Å; F130-A148 HydrophobicContact CE2-CB 3.84Å; F130-A148 HydrophobicContact CZ-CB 4.21Å; R144-A148 WeakPolarHBondContact O-CB 3.41Å; R144-A148 PolarHBondContact O-N 2.85Å; R144-A148 VanDerWaalsContact O-N 3.17Å; K145-A148 PolarHBondContact O-N 3.34Å; A148-L152 PolarHBondContact O-N 3.42Å
149	G	97.6	Very high	96	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-50	176.3	0	0	0	0	0	112.2	K145 C146 A151 L152 L153 Y169 L184	K145-G149 PolarHBondContact O-N 3.45Å; C146-G149 PolarHBondContact O-N 3.28Å; G149-A151 VanDerWaalsContact C-N 3.28Å; G149-A151 PolarHBondContact O-N 3.27Å; G149-L152 PolarHBondContact O-N 3.18Å; G149-L153 PolarHBondContact O-N 2.78Å; G149-Y169 VanDerWaalsContact C-OH 3.29Å; G149-Y169 VanDerWaalsContact CA-OH 3.29Å; G149-Y169 WeakPolarHBondContact CA-OH 3.39Å; G149-Y169 PolarHBondContact O-OH 2.59Å; G149-L184 VanDerWaalsContact C-CD1 3.46Å
150	A	97.9	Very high	96.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-31.7	-178.2	0	0	0	0	0	112.2	C146 L152 L153 V154 L184 I191	C146-A150 WeakPolarHBondContact O-CB 3.43Å; C146-A150 PolarHBondContact O-N 2.98Å; A150-L152 VanDerWaalsContact C-N 3.35Å; A150-L152 PolarHBondContact O-N 3.08Å; A150-L153 WeakPolarHBondContact O-CB 3.44Å; A150-L153 PolarHBondContact O-N 2.93Å; A150-V154 WeakPolarHBondContact O-CB 3.46Å; A150-V154 VanDerWaalsContact O-CG2 3.27Å; A150-V154 WeakPolarHBondContact O-CG2 3.44Å; A150-V154 PolarHBondContact O-N 3.37Å; A150-L184 HydrophobicContact CB-CD1 4.29Å; A150-L184 VanDerWaalsContact N-CD1 3.34Å; A150-I191 HydrophobicContact CB-CD1 3.41Å; A150-I191 VanDerWaalsContact CB-CD1 3.41Å
151	A	97.9	Very high	96.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-43.1	171	0	0	0	0	0	112.1	M109 F130 V147 G149 A155	M109-A151 HydrophobicContact CE-CB 4.49Å; F130-A151 HydrophobicContact CB-CB 4.37Å; V147-A151 VanDerWaalsContact O-CB 3.22Å; V147-A151 WeakPolarHBondContact O-CB 3.42Å; V147-A151 PolarHBondContact O-N 3.12Å; G149-A151 VanDerWaalsContact C-N 3.28Å; G149-A151 PolarHBondContact O-N 3.27Å; A151-A155 PolarHBondContact O-N 2.91Å; A151-A155 VanDerWaalsContact O-N 3.07Å
152	L	98.1	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-44.3	174.4	-175.5	55.8	0	0	0	111.3	M109 L112 V123 A126 A148 G149 A150 V154 A155 L156 Y169	M109-L152 HydrophobicContact CB-CD2 4.35Å; M109-L152 HydrophobicContact CE-CB 4.11Å; L112-L152 HydrophobicContact CB-CD2 4.04Å; V123-L152 HydrophobicContact CG2-CD1 4.49Å; A126-L152 HydrophobicContact CB-CB 4.02Å; A126-L152 HydrophobicContact CB-CD1 3.67Å; A126-L152 HydrophobicContact CB-CG 4.46Å; A148-L152 PolarHBondContact O-N 3.42Å; G149-L152 PolarHBondContact O-N 3.18Å; A150-L152 VanDerWaalsContact C-N 3.35Å; A150-L152 PolarHBondContact O-N 3.08Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 2.92Å; L152-A155 WeakPolarHBondContact O-CB 3.35Å; L152-A155 PolarHBondContact O-N 3.46Å; L152-A155 VanDerWaalsContact O-N 3.09Å; L152-L156 HydrophobicContact CD1-CD1 3.54Å; L152-L156 HydrophobicContact CG-CD1 3.68Å; L152-L156 WeakPolarHBondContact O-CD1 3.49Å; L152-L156 PolarHBondContact O-N 3.48Å; L152-Y169 HydrophobicContact CB-CE2 4.42Å; L152-Y169 HydrophobicContact CD2-CD2 4.38Å; L152-Y169 HydrophobicContact CD2-CE2 3.58Å; L152-Y169 HydrophobicContact CG-CE2 3.92Å
153	L	98	Very high	96.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-54.1	-46.1	175.1	-178.5	59.4	0	0	0	112.5	G149 A150 L156 K157 I166 Y169 I170 L185	G149-L153 PolarHBondContact O-N 2.78Å; A150-L153 WeakPolarHBondContact O-CB 3.44Å; A150-L153 PolarHBondContact O-N 2.93Å; L153-L156 PolarHBondContact O-N 3.4Å; L153-K157 WeakPolarHBondContact O-CG 3.28Å; L153-K157 PolarHBondContact O-N 3.03Å; L153-I166 HydrophobicContact CD1-CG2 3.75Å; L153-Y169 HydrophobicContact CB-CE1 3.82Å; L153-Y169 HydrophobicContact CD1-CD1 3.98Å; L153-Y169 HydrophobicContact CD1-CE1 3.98Å; L153-Y169 HydrophobicContact CG-CE1 4.44Å; L153-I170 HydrophobicContact CD1-CD1 4.25Å; L153-I170 HydrophobicContact CD1-CG1 4.16Å; L153-L185 HydrophobicContact CD2-CD2 3.88Å
154	V	98.1	Very high	96.9	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-45.2	176.9	170.8	0	0	0	0	110.1	Y129 A150 L152 L156 K157 M158 E188 L199	Y129-V154 HydrophobicContact CD2-CG1 4.48Å; Y129-V154 HydrophobicContact CE2-CG1 4.12Å; A150-V154 WeakPolarHBondContact O-CB 3.46Å; A150-V154 VanDerWaalsContact O-CG2 3.27Å; A150-V154 WeakPolarHBondContact O-CG2 3.44Å; A150-V154 PolarHBondContact O-N 3.37Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 2.92Å; V154-L156 VanDerWaalsContact C-N 3.34Å; V154-L156 PolarHBondContact O-N 2.96Å; V154-K157 PolarHBondContact O-N 3.31Å; V154-K157 VanDerWaalsContact O-N 3.15Å; V154-M158 HydrophobicContact CG1-CG 4.18Å; V154-M158 VanDerWaalsContact O-CG 3.26Å; V154-M158 WeakPolarHBondContact O-CG 3.47Å; V154-M158 PolarHBondContact O-N 3.49Å; V154-E188 HydrophobicContact CG2-CG 3.93Å; V154-L199 HydrophobicContact CG1-CD1 4.02Å; V154-L199 HydrophobicContact CG1-CD2 3.94Å
155	A	98	Very high	96.9	Very high	3 Å²	3	44.9 Å²	44.9	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-42.5	176.6	0	0	0	0	0	112.7	T122 T125 A126 Y129 A151 L152 K157 M158 N159	T122-A155 HydrophobicContact CG2-CB 3.96Å; T125-A155 HydrophobicContact CG2-CB 4.29Å; A126-A155 HydrophobicContact CB-CB 3.86Å; Y129-A155 HydrophobicContact CD2-CB 4.33Å; Y129-A155 HydrophobicContact CE2-CB 3.93Å; A151-A155 PolarHBondContact O-N 2.91Å; A151-A155 VanDerWaalsContact O-N 3.07Å; L152-A155 WeakPolarHBondContact O-CB 3.35Å; L152-A155 PolarHBondContact O-N 3.46Å; L152-A155 VanDerWaalsContact O-N 3.09Å; A155-K157 VanDerWaalsContact C-N 3.34Å; A155-K157 PolarHBondContact O-N 3.03Å; A155-M158 PolarHBondContact O-N 2.9Å; A155-N159 PolarHBondContact O-N 3.03Å
156	L	97.8	Very high	96.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-44.2	174.6	-89.5	76.3	0	0	0	111.8	I118 T122 L152 L153 V154 M158 N159 D160 Y161 I166 Y169	I118-L156 HydrophobicContact CD1-CD1 3.82Å; I118-L156 HydrophobicContact CD1-CD2 3.94Å; I118-L156 HydrophobicContact CD1-CG 4.24Å; I118-L156 HydrophobicContact CG1-CD1 4.28Å; I118-L156 HydrophobicContact CG1-CD2 4.18Å; I118-L156 HydrophobicContact CG1-CG 4.32Å; I118-L156 HydrophobicContact CG2-CD1 4.22Å; T122-L156 HydrophobicContact CG2-CD1 4.03Å; T122-L156 HydrophobicContact CG2-CG 4.42Å; L152-L156 HydrophobicContact CD1-CD1 3.54Å; L152-L156 HydrophobicContact CG-CD1 3.68Å; L152-L156 WeakPolarHBondContact O-CD1 3.49Å; L152-L156 PolarHBondContact O-N 3.48Å; L153-L156 PolarHBondContact O-N 3.4Å; V154-L156 VanDerWaalsContact C-N 3.34Å; V154-L156 PolarHBondContact O-N 2.96Å; L156-M158 VanDerWaalsContact C-N 3.34Å; L156-N159 PolarHBondContact O-N 3.38Å; L156-D160 PolarHBondContact O-N 3.13Å; L156-Y161 HydrophobicContact CB-CD2 4.24Å; L156-Y161 HydrophobicContact CB-CG 4.37Å; L156-Y161 HydrophobicContact CG-CD2 4.22Å; L156-Y161 HydrophobicContact CG-CG 4.22Å; L156-Y161 WeakPolarHBondContact O-CB 3.36Å; L156-Y161 VanDerWaalsContact O-CD2 3.3Å; L156-Y161 WeakPolarHBondContact O-CD2 3.49Å; L156-Y161 PolarHBondContact O-N 2.89Å; L156-I166 HydrophobicContact CB-CG1 4.45Å; L156-I166 HydrophobicContact CD2-CG1 4.38Å; L156-Y169 HydrophobicContact CD2-CD1 4.34Å; L156-Y169 HydrophobicContact CD2-CG 4.02Å
157	K	96.6	Very high	96.9	Very high	78 Å²	78	50.2 Å²	50.2	34%	0.339	25%	0.246	S	C	.	.	H	α-helix	trans	-65.8	-38.8	178.9	-74.6	179.8	171.7	-173.2	0	111.8	L153 V154 A155 N159 D160 I166 E188	L153-K157 WeakPolarHBondContact O-CG 3.28Å; L153-K157 PolarHBondContact O-N 3.03Å; V154-K157 PolarHBondContact O-N 3.31Å; V154-K157 VanDerWaalsContact O-N 3.15Å; A155-K157 VanDerWaalsContact C-N 3.34Å; A155-K157 PolarHBondContact O-N 3.03Å; K157-N159 VanDerWaalsContact C-N 3.28Å; K157-N159 PolarHBondContact O-N 3.45Å; K157-D160 PolarHBondContact O-N 3.43Å; K157-I166 HydrophobicContact CG-CD1 4.01Å; K157-E188 WeakPolarHBondContact CD-OE1 3.43Å; K157-E188 IonicContact NZ-OE1 2.69Å; K157-E188 PolarHBondContact NZ-OE1 3.3Å; K157-E188 IonicContact NZ-OE2 3.77Å; K157-E188 PolarHBondContact NZ-OE2 3.41Å
158	M	96.3	Very high	96.9	Very high	81 Å²	81	52.2 Å²	52.2	40%	0.399	26%	0.26	S	S	.	.	H	α-helix	trans	-70.1	-24.6	178.7	-69	-55.5	-56.1	0	0	113.4	V154 A155 L156 L199	V154-M158 HydrophobicContact CG1-CG 4.18Å; V154-M158 VanDerWaalsContact O-CG 3.26Å; V154-M158 WeakPolarHBondContact O-CG 3.47Å; V154-M158 PolarHBondContact O-N 3.49Å; A155-M158 PolarHBondContact O-N 2.9Å; L156-M158 VanDerWaalsContact C-N 3.34Å; M158-L199 HydrophobicContact CE-CB 3.82Å; M158-L199 HydrophobicContact CE-CD1 4.36Å; M158-L199 HydrophobicContact CG-CB 3.97Å; M158-L199 HydrophobicContact CG-CD1 4.04Å; M158-L199 HydrophobicContact SD-CB 3.96Å; M158-L199 HydrophobicContact SD-CD1 3.55Å; M158-L199 VanDerWaalsContact SD-CD1 3.55Å; M158-L199 HydrophobicContact SD-CG 4.42Å
159	N	95.7	Very high	96.9	Very high	74 Å²	74	52.2 Å²	52.2	40%	0.396	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	25.8	176.3	-157.9	31.2	0	0	0	112.8	D119 T122 A155 L156 K157 Y161	D119-N159 PolarHBondContact OD1-ND2 3.21Å; D119-N159 VanDerWaalsContact OD1-ND2 3.12Å; T122-N159 PolarHBondContact OG1-ND2 2.9Å; A155-N159 PolarHBondContact O-N 3.03Å; L156-N159 PolarHBondContact O-N 3.38Å; K157-N159 VanDerWaalsContact C-N 3.28Å; K157-N159 PolarHBondContact O-N 3.45Å; N159-Y161 VanDerWaalsContact C-N 3.29Å; N159-Y161 HydrophobicContact CB-CD2 4.06Å; N159-Y161 HydrophobicContact CB-CE2 3.95Å; N159-Y161 PolarHBondContact O-N 3.09Å; N159-Y161 VanDerWaalsContact O-N 3.12Å
160	D	94.9	Very high	96.9	Very high	153 Å²	153	53.5 Å²	53.5	82%	0.818	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	35.2	171.9	-68.9	-48.9	0	0	0	115.8	L156 K157	L156-D160 PolarHBondContact O-N 3.13Å; K157-D160 PolarHBondContact O-N 3.43Å
161	Y	96.7	Very high	96.8	Very high	42 Å²	42	58.6 Å²	58.6	17%	0.165	29%	0.29	C	S	.	.			trans	-61.3	144.9	176.1	-85.1	-99.9	0	0	0	112.5	I118 D119 T122 L156 N159 T165 I166	I118-Y161 WeakPolarHBondContact CA-OH 3.11Å; I118-Y161 HydrophobicContact CB-CE1 4.43Å; I118-Y161 HydrophobicContact CG1-CE1 4.23Å; I118-Y161 HydrophobicContact CG2-CE1 4.41Å; I118-Y161 HydrophobicContact CG2-CE2 4.5Å; D119-Y161 PolarHBondContact N-OH 2.74Å; D119-Y161 PolarHBondContact OD1-OH 2.99Å; T122-Y161 HydrophobicContact CG2-CE2 3.93Å; T122-Y161 WeakPolarHBondContact OG1-CE2 3.47Å; L156-Y161 HydrophobicContact CB-CD2 4.24Å; L156-Y161 HydrophobicContact CB-CG 4.37Å; L156-Y161 HydrophobicContact CG-CD2 4.22Å; L156-Y161 HydrophobicContact CG-CG 4.22Å; L156-Y161 WeakPolarHBondContact O-CB 3.36Å; L156-Y161 VanDerWaalsContact O-CD2 3.3Å; L156-Y161 WeakPolarHBondContact O-CD2 3.49Å; L156-Y161 PolarHBondContact O-N 2.89Å; N159-Y161 VanDerWaalsContact C-N 3.29Å; N159-Y161 HydrophobicContact CB-CD2 4.06Å; N159-Y161 HydrophobicContact CB-CE2 3.95Å; N159-Y161 PolarHBondContact O-N 3.09Å; N159-Y161 VanDerWaalsContact O-N 3.12Å; Y161-T165 HydrophobicContact CD1-CG2 3.83Å; Y161-T165 HydrophobicContact CE1-CG2 4.42Å; Y161-I166 WeakPolarHBondContact O-CD1 3.34Å
162	K	96	Very high	96.7	Very high	158 Å²	158	61.5 Å²	61.5	69%	0.687	30%	0.304	S	S	*	.			trans	-59.7	143.6	177.9	-65.9	-180	-176.5	173.6	0	110.8	S164 T165 I166	K162-S164 PolarHBondContact O-N 3.24Å; K162-S164 VanDerWaalsContact O-N 3.08Å; K162-T165 WeakPolarHBondContact O-CB 3.34Å; K162-T165 PolarHBondContact O-N 3.18Å; K162-I166 PolarHBondContact O-N 3.47Å; K162-I166 VanDerWaalsContact O-N 3.08Å
163	K	95.6	Very high	96.6	Very high	189 Å²	189	61.6 Å²	61.6	82%	0.822	30%	0.304	S	S	*	.	H	α-helix	trans	-52.4	-34.1	176.1	-66.8	-175.4	179.1	-179.6	0	113.4	K167	K163-K167 WeakPolarHBondContact O-CB 3.32Å; K163-K167 PolarHBondContact O-N 2.69Å
164	S	96.3	Very high	96.5	Very high	82 Å²	82	64.5 Å²	64.5	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-41.8	175.9	53.5	0	0	0	0	112.5	K162 K167 S168	K162-S164 PolarHBondContact O-N 3.24Å; K162-S164 VanDerWaalsContact O-N 3.08Å; S164-K167 PolarHBondContact O-N 3.29Å; S164-S168 PolarHBondContact O-N 3.38Å
165	T	96.3	Very high	96.3	Very high	34 Å²	34	70.5 Å²	70.5	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-43.3	178	-51.8	0	0	0	0	110.7	Y161 K162 K167 S168 Y169	Y161-T165 HydrophobicContact CD1-CG2 3.83Å; Y161-T165 HydrophobicContact CE1-CG2 4.42Å; K162-T165 WeakPolarHBondContact O-CB 3.34Å; K162-T165 PolarHBondContact O-N 3.18Å; T165-K167 VanDerWaalsContact C-N 3.29Å; T165-K167 PolarHBondContact O-N 2.88Å; T165-S168 PolarHBondContact O-N 2.89Å; T165-Y169 WeakPolarHBondContact O-CB 3.33Å; T165-Y169 PolarHBondContact O-N 2.78Å
166	I	96.9	Very high	96.2	Very high	23 Å²	23	73 Å²	73	12%	0.118	36%	0.361	C	S	.	.	H	α-helix	trans	-60.6	-41.2	175.7	-64.9	170.6	0	0	0	110.9	L153 L156 K157 Y161 K162 Y169 I170	L153-I166 HydrophobicContact CD1-CG2 3.75Å; L156-I166 HydrophobicContact CB-CG1 4.45Å; L156-I166 HydrophobicContact CD2-CG1 4.38Å; K157-I166 HydrophobicContact CG-CD1 4.01Å; Y161-I166 WeakPolarHBondContact O-CD1 3.34Å; K162-I166 PolarHBondContact O-N 3.47Å; K162-I166 VanDerWaalsContact O-N 3.08Å; I166-Y169 PolarHBondContact O-N 2.89Å; I166-I170 HydrophobicContact CG2-CD1 3.98Å; I166-I170 WeakPolarHBondContact O-CG1 3.01Å; I166-I170 PolarHBondContact O-N 3.23Å
167	K	96.4	Very high	96	Very high	134 Å²	134	73.1 Å²	73.1	58%	0.583	36%	0.361	S	S	*	.	H	α-helix	trans	-64.6	-47.4	177.1	-170.6	-174.4	178.3	-157.9	0	112	K163 S164 T165 Y169 I170 E171	K163-K167 WeakPolarHBondContact O-CB 3.32Å; K163-K167 PolarHBondContact O-N 2.69Å; S164-K167 PolarHBondContact O-N 3.29Å; T165-K167 VanDerWaalsContact C-N 3.29Å; T165-K167 PolarHBondContact O-N 2.88Å; K167-Y169 VanDerWaalsContact C-N 3.27Å; K167-Y169 PolarHBondContact O-N 3.37Å; K167-I170 PolarHBondContact O-N 2.94Å; K167-E171 WeakPolarHBondContact CE-OE1 3.42Å; K167-E171 IonicContact NZ-OE1 3.29Å; K167-E171 WeakPolarHBondContact O-CG 3.34Å; K167-E171 PolarHBondContact O-N 3.13Å; K167-E171 VanDerWaalsContact O-N 3.1Å
168	S	96.6	Very high	95.9	Very high	42 Å²	42	79.4 Å²	79.4	29%	0.294	38%	0.383	S	S	.	.	H	α-helix	trans	-56.2	-44.4	174.7	176.4	0	0	0	0	111.3	N116 S164 T165 E171 Q172	N116-S168 WeakPolarHBondContact OD1-CB 3.27Å; N116-S168 PolarHBondContact OD1-OG 2.99Å; S164-S168 PolarHBondContact O-N 3.38Å; T165-S168 PolarHBondContact O-N 2.89Å; S168-E171 PolarHBondContact O-N 3.45Å; S168-Q172 WeakPolarHBondContact O-CG 3.32Å; S168-Q172 PolarHBondContact O-N 2.79Å; S168-Q172 PolarHBondContact OG-NE2 3.31Å
169	Y	97.5	Very high	95.8	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-47.3	177.2	164.2	-96.7	0	0	0	112.1	L112 N116 I118 G149 L152 L153 L156 T165 I166 K167 E171 Q172 A173 L184	L112-Y169 HydrophobicContact CB-CD2 4.42Å; L112-Y169 HydrophobicContact CB-CE2 4.14Å; L112-Y169 HydrophobicContact CD1-CE2 3.95Å; L112-Y169 HydrophobicContact CG-CE2 4.45Å; N116-Y169 WeakPolarHBondContact OD1-CA 3.46Å; N116-Y169 PolarHBondContact OD1-N 2.92Å; I118-Y169 HydrophobicContact CD1-CD2 4.34Å; G149-Y169 VanDerWaalsContact C-OH 3.29Å; G149-Y169 VanDerWaalsContact CA-OH 3.29Å; G149-Y169 WeakPolarHBondContact CA-OH 3.39Å; G149-Y169 PolarHBondContact O-OH 2.59Å; L152-Y169 HydrophobicContact CB-CE2 4.42Å; L152-Y169 HydrophobicContact CD2-CD2 4.38Å; L152-Y169 HydrophobicContact CD2-CE2 3.58Å; L152-Y169 HydrophobicContact CG-CE2 3.92Å; L153-Y169 HydrophobicContact CB-CE1 3.82Å; L153-Y169 HydrophobicContact CD1-CD1 3.98Å; L153-Y169 HydrophobicContact CD1-CE1 3.98Å; L153-Y169 HydrophobicContact CG-CE1 4.44Å; L156-Y169 HydrophobicContact CD2-CD1 4.34Å; L156-Y169 HydrophobicContact CD2-CG 4.02Å; T165-Y169 WeakPolarHBondContact O-CB 3.33Å; T165-Y169 PolarHBondContact O-N 2.78Å; I166-Y169 PolarHBondContact O-N 2.89Å; K167-Y169 VanDerWaalsContact C-N 3.27Å; K167-Y169 PolarHBondContact O-N 3.37Å; Y169-E171 VanDerWaalsContact C-N 3.33Å; Y169-E171 PolarHBondContact O-N 2.86Å; Y169-Q172 PolarHBondContact O-N 3.3Å; Y169-A173 HydrophobicContact CE1-CB 4.37Å; Y169-A173 HydrophobicContact CE2-CB 4.16Å; Y169-A173 WeakPolarHBondContact O-CB 3.2Å; Y169-A173 PolarHBondContact O-N 2.91Å; Y169-L184 HydrophobicContact CE1-CD2 4.45Å
170	I	97.1	Very high	95.8	Very high	27 Å²	27	76.5 Å²	76.5	14%	0.138	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-42.7	179.8	-68.9	163.7	0	0	0	111.1	L153 I166 K167 A173 E174 K181 L185	L153-I170 HydrophobicContact CD1-CD1 4.25Å; L153-I170 HydrophobicContact CD1-CG1 4.16Å; I166-I170 HydrophobicContact CG2-CD1 3.98Å; I166-I170 WeakPolarHBondContact O-CG1 3.01Å; I166-I170 PolarHBondContact O-N 3.23Å; K167-I170 PolarHBondContact O-N 2.94Å; I170-A173 PolarHBondContact O-N 3.38Å; I170-E174 PolarHBondContact O-N 3.29Å; I170-K181 HydrophobicContact CG2-CB 3.83Å; I170-L185 HydrophobicContact CD1-CD2 4.15Å
171	E	96	Very high	95.8	Very high	106 Å²	106	74.5 Å²	74.5	50%	0.495	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-46	178	-70.3	171.9	-178.7	0	0	111.1	K167 S168 Y169	K167-E171 WeakPolarHBondContact CE-OE1 3.42Å; K167-E171 IonicContact NZ-OE1 3.29Å; K167-E171 WeakPolarHBondContact O-CG 3.34Å; K167-E171 PolarHBondContact O-N 3.13Å; K167-E171 VanDerWaalsContact O-N 3.1Å; S168-E171 PolarHBondContact O-N 3.45Å; Y169-E171 VanDerWaalsContact C-N 3.33Å; Y169-E171 PolarHBondContact O-N 2.86Å
172	Q	96.2	Very high	95.8	Very high	62 Å²	62	75.9 Å²	75.9	29%	0.29	37%	0.37	S	S	.	.	H	α-helix	trans	-70.3	-34.7	178.1	-68.9	-178.7	24.6	0	0	113.4	L112 S115 N116 S168 Y169 E174 D175 Q176	L112-Q172 HydrophobicContact CD2-CB 4.03Å; S115-Q172 VanDerWaalsContact CB-OE1 3.27Å; N116-Q172 PolarHBondContact ND2-OE1 2.82Å; N116-Q172 PolarHBondContact OD1-NE2 3.39Å; S168-Q172 WeakPolarHBondContact O-CG 3.32Å; S168-Q172 PolarHBondContact O-N 2.79Å; S168-Q172 PolarHBondContact OG-NE2 3.31Å; Y169-Q172 PolarHBondContact O-N 3.3Å; Q172-E174 VanDerWaalsContact C-N 3.32Å; Q172-E174 PolarHBondContact O-N 3.32Å; Q172-D175 PolarHBondContact O-N 2.99Å; Q172-Q176 PolarHBondContact O-N 2.89Å
173	A	96.3	Very high	95.7	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.008	36%	0.355	C	S	.	.	H	α-helix	trans	-65.5	-36.7	179.1	0	0	0	0	0	111.6	L112 Y169 I170 D175 L177 L184	L112-A173 HydrophobicContact CD1-CB 4.2Å; L112-A173 HydrophobicContact CD2-CB 4.49Å; Y169-A173 HydrophobicContact CE1-CB 4.37Å; Y169-A173 HydrophobicContact CE2-CB 4.16Å; Y169-A173 WeakPolarHBondContact O-CB 3.2Å; Y169-A173 PolarHBondContact O-N 2.91Å; I170-A173 PolarHBondContact O-N 3.38Å; A173-D175 VanDerWaalsContact C-N 3.32Å; A173-D175 PolarHBondContact O-N 3.31Å; A173-L177 HydrophobicContact CB-CD1 4.31Å; A173-L177 VanDerWaalsContact O-CB 3.24Å; A173-L177 WeakPolarHBondContact O-CB 3.35Å; A173-L177 PolarHBondContact O-N 2.9Å; A173-L184 HydrophobicContact CB-CD2 4.01Å
174	E	95.3	Very high	95.6	Very high	61 Å²	61	62.9 Å²	62.9	29%	0.285	32%	0.317	S	S	.	.	I	π-helix	trans	-58	-45.3	175.1	179.2	162.1	-131.8	0	0	111.1	I170 Q172 R178 E179 K181	I170-E174 PolarHBondContact O-N 3.29Å; Q172-E174 VanDerWaalsContact C-N 3.32Å; Q172-E174 PolarHBondContact O-N 3.32Å; E174-R178 WeakPolarHBondContact O-CA 3.31Å; E174-R178 PolarHBondContact O-N 3.24Å; E174-E179 WeakPolarHBondContact CA-O 3.19Å; E174-K181 PolarHBondContact OE1-N 3.05Å; E174-K181 VanDerWaalsContact OE1-N 3.08Å; E174-K181 IonicContact OE2-NZ 3.97Å
175	D	94.3	Very high	95.6	Very high	131 Å²	131	62.6 Å²	62.6	70%	0.701	31%	0.309	S	S	*	.	I	π-helix	trans	-70.8	-46.6	178.8	-72.9	-31.6	0	0	0	113.1	Q172 A173	Q172-D175 PolarHBondContact O-N 2.99Å; A173-D175 VanDerWaalsContact C-N 3.32Å; A173-D175 PolarHBondContact O-N 3.31Å
176	Q	95.1	Very high	95.7	Very high	56 Å²	56	62.9 Å²	62.9	26%	0.262	31%	0.314	S	S	.	.	I	π-helix	trans	-76.1	-47.1	-172.9	-160.2	-163.3	56	0	0	112.2	E108 E111 L112 Q172 R178	E108-Q176 PolarHBondContact O-OE1 2.97Å; E111-Q176 PolarHBondContact OE2-NE2 3.18Å; E111-Q176 VanDerWaalsContact OE2-NE2 3.11Å; L112-Q176 HydrophobicContact CD2-CB 4.19Å; Q172-Q176 PolarHBondContact O-N 2.89Å; Q176-R178 VanDerWaalsContact C-N 3.26Å; Q176-R178 PolarHBondContact O-N 2.91Å
177	L	94	Very high	95.6	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	31%	0.314	C	S	.	.	I	π-helix	trans	-75.4	-20.9	177.7	-59.8	174.2	0	0	0	111	E108 L112 K145 A173 E179	E108-L177 HydrophobicContact CB-CD2 4.44Å; L112-L177 HydrophobicContact CD1-CD1 4.43Å; L112-L177 HydrophobicContact CD1-CG 4.38Å; K145-L177 WeakPolarHBondContact CD-O 3.46Å; K145-L177 WeakPolarHBondContact CE-O 3.47Å; K145-L177 PolarHBondContact NZ-O 2.82Å; A173-L177 HydrophobicContact CB-CD1 4.31Å; A173-L177 VanDerWaalsContact O-CB 3.24Å; A173-L177 WeakPolarHBondContact O-CB 3.35Å; A173-L177 PolarHBondContact O-N 2.9Å; L177-E179 VanDerWaalsContact C-N 3.26Å; L177-E179 HydrophobicContact CB-CG 4.37Å
178	R	94.8	Very high	95.6	Very high	209 Å²	209	58.6 Å²	58.6	79%	0.789	30%	0.295	S	S	*	.	I	π-helix	trans	58.7	40.2	-174.6	-50	-177.9	178.7	-154.5	-2.8	112	E174 Q176	E174-R178 WeakPolarHBondContact O-CA 3.31Å; E174-R178 PolarHBondContact O-N 3.24Å; Q176-R178 VanDerWaalsContact C-N 3.26Å; Q176-R178 PolarHBondContact O-N 2.91Å
179	E	93.4	Very high	95.6	Very high	45 Å²	45	62.3 Å²	62.3	21%	0.21	31%	0.311	C	S	.	.			trans	-123.4	139.1	174.4	-61.9	-61.2	163.2	0	0	107.8	K145 E174 L177	K145-E179 HydrophobicContact CB-CG 3.6Å; K145-E179 HydrophobicContact CD-CG 4.12Å; K145-E179 WeakPolarHBondContact CD-OE1 3.3Å; E174-E179 WeakPolarHBondContact CA-O 3.19Å; L177-E179 VanDerWaalsContact C-N 3.26Å; L177-E179 HydrophobicContact CB-CG 4.37Å
180	P	95.4	Very high	95.6	Very high	49 Å²	49	63.9 Å²	63.9	32%	0.318	32%	0.321	S	S	.	.			trans	-66.7	146.7	-177.2	30	-35.2	0	0	0	110.5	S182 D183 L184	P180-S182 PolarHBondContact O-N 3.08Å; P180-S182 VanDerWaalsContact O-N 3.12Å; P180-D183 HydrophobicContact CG-CB 3.86Å; P180-D183 WeakPolarHBondContact CG-OD2 3.18Å; P180-D183 PolarHBondContact O-N 3.25Å; P180-L184 PolarHBondContact O-N 3.18Å; P180-L184 VanDerWaalsContact O-N 3.14Å
181	K	95.6	Very high	95.5	Very high	112 Å²	112	62.6 Å²	62.6	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-58	-28.1	178.3	65.1	-169.5	166.1	-152.8	0	113.9	I170 E174 D183 L185	I170-K181 HydrophobicContact CG2-CB 3.83Å; E174-K181 PolarHBondContact OE1-N 3.05Å; E174-K181 VanDerWaalsContact OE1-N 3.08Å; E174-K181 IonicContact OE2-NZ 3.97Å; K181-D183 VanDerWaalsContact C-N 3.32Å; K181-L185 WeakPolarHBondContact O-CB 3.4Å; K181-L185 VanDerWaalsContact O-CG 3.22Å; K181-L185 WeakPolarHBondContact O-CG 3.44Å; K181-L185 PolarHBondContact O-N 3.24Å
182	S	96	Very high	95.6	Very high	71 Å²	71	58 Å²	58	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-60.1	-44.7	174.9	53.3	0	0	0	0	111.3	P180 L185 A186	P180-S182 PolarHBondContact O-N 3.08Å; P180-S182 VanDerWaalsContact O-N 3.12Å; S182-L185 PolarHBondContact O-N 3.46Å; S182-A186 WeakPolarHBondContact O-CB 3.39Å; S182-A186 PolarHBondContact O-N 3.08Å
183	D	94.3	Very high	95.6	Very high	69 Å²	69	58.6 Å²	58.6	37%	0.369	31%	0.305	S	S	.	.	H	α-helix	trans	-73.8	-43.2	-176.3	-65.4	7.7	0	0	0	108.9	P180 K181 L185 A186 Y187	P180-D183 HydrophobicContact CG-CB 3.86Å; P180-D183 WeakPolarHBondContact CG-OD2 3.18Å; P180-D183 PolarHBondContact O-N 3.25Å; K181-D183 VanDerWaalsContact C-N 3.32Å; D183-L185 VanDerWaalsContact C-N 3.3Å; D183-L185 PolarHBondContact O-N 2.91Å; D183-A186 PolarHBondContact O-N 3.26Å; D183-A186 VanDerWaalsContact O-N 3.07Å; D183-Y187 VanDerWaalsContact O-CD2 3.29Å; D183-Y187 WeakPolarHBondContact O-CD2 3.45Å; D183-Y187 PolarHBondContact O-N 3.31Å
184	L	94.5	Very high	95.5	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-51.7	-49.5	173.3	-174.2	69.8	0	0	0	112	G149 A150 Y169 A173 P180 A186 Y187	G149-L184 VanDerWaalsContact C-CD1 3.46Å; A150-L184 HydrophobicContact CB-CD1 4.29Å; A150-L184 VanDerWaalsContact N-CD1 3.34Å; Y169-L184 HydrophobicContact CE1-CD2 4.45Å; A173-L184 HydrophobicContact CB-CD2 4.01Å; P180-L184 PolarHBondContact O-N 3.18Å; P180-L184 VanDerWaalsContact O-N 3.14Å; L184-A186 VanDerWaalsContact C-N 3.34Å; L184-A186 PolarHBondContact O-N 3.17Å; L184-Y187 PolarHBondContact O-N 3.34Å
185	L	96.4	Very high	95.5	Very high	77 Å²	77	57.4 Å²	57.4	40%	0.403	30%	0.301	S	S	.	.	H	α-helix	trans	-68.3	-32.8	179.3	-68.9	173.9	0	0	0	112.6	L153 I170 K181 S182 D183 Y187 E188	L153-L185 HydrophobicContact CD2-CD2 3.88Å; I170-L185 HydrophobicContact CD1-CD2 4.15Å; K181-L185 WeakPolarHBondContact O-CB 3.4Å; K181-L185 VanDerWaalsContact O-CG 3.22Å; K181-L185 WeakPolarHBondContact O-CG 3.44Å; K181-L185 PolarHBondContact O-N 3.24Å; S182-L185 PolarHBondContact O-N 3.46Å; D183-L185 VanDerWaalsContact C-N 3.3Å; D183-L185 PolarHBondContact O-N 2.91Å; L185-Y187 PolarHBondContact O-N 2.82Å; L185-E188 VanDerWaalsContact O-CB 3.31Å; L185-E188 WeakPolarHBondContact O-CB 3.32Å; L185-E188 PolarHBondContact O-N 3.14Å
186	A	96.9	Very high	95.5	Very high	39 Å²	39	56.7 Å²	56.7	32%	0.322	29%	0.294	S	S	.	.	H	α-helix	trans	-67.4	-25.7	178.8	0	0	0	0	0	112.8	V8 S182 D183 L184 P190	V8-A186 HydrophobicContact CG1-CB 3.57Å; S182-A186 WeakPolarHBondContact O-CB 3.39Å; S182-A186 PolarHBondContact O-N 3.08Å; D183-A186 PolarHBondContact O-N 3.26Å; D183-A186 VanDerWaalsContact O-N 3.07Å; L184-A186 VanDerWaalsContact C-N 3.34Å; L184-A186 PolarHBondContact O-N 3.17Å; A186-P190 WeakPolarHBondContact O-CD 3.47Å; A186-P190 VanDerWaalsContact O-CG 3.27Å; A186-P190 WeakPolarHBondContact O-CG 3.47Å
187	Y	96.5	Very high	95.5	Very high	28 Å²	28	60.5 Å²	60.5	11%	0.11	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.5	175	-82.6	-91.1	0	0	0	114.4	I6 V8 N143 C146 V147 D183 L184 L185 I191	I6-Y187 HydrophobicContact CB-CD1 4.48Å; I6-Y187 HydrophobicContact CB-CE1 3.96Å; I6-Y187 HydrophobicContact CG2-CD1 3.76Å; I6-Y187 HydrophobicContact CG2-CE1 3.56Å; V8-Y187 HydrophobicContact CB-CE2 4.38Å; V8-Y187 HydrophobicContact CG2-CD1 3.91Å; V8-Y187 HydrophobicContact CG2-CD2 3.82Å; V8-Y187 HydrophobicContact CG2-CE1 3.66Å; V8-Y187 HydrophobicContact CG2-CE2 3.57Å; V8-Y187 HydrophobicContact CG2-CG 3.99Å; V8-Y187 VanDerWaalsContact CG2-CZ 3.47Å; N143-Y187 HydrophobicContact CB-CE1 3.79Å; N143-Y187 VanDerWaalsContact CB-OH 3.23Å; N143-Y187 WeakPolarHBondContact CB-OH 3.44Å; C146-Y187 HydrophobicContact CB-CD2 3.48Å; C146-Y187 VanDerWaalsContact CB-CD2 3.48Å; C146-Y187 HydrophobicContact CB-CE2 3.77Å; C146-Y187 HydrophobicContact CB-CG 3.99Å; V147-Y187 HydrophobicContact CG2-CD1 3.84Å; V147-Y187 HydrophobicContact CG2-CE1 4.01Å; D183-Y187 VanDerWaalsContact O-CD2 3.29Å; D183-Y187 WeakPolarHBondContact O-CD2 3.45Å; D183-Y187 PolarHBondContact O-N 3.31Å; L184-Y187 PolarHBondContact O-N 3.34Å; L185-Y187 PolarHBondContact O-N 2.82Å; Y187-I191 WeakPolarHBondContact O-CB 3.33Å; Y187-I191 VanDerWaalsContact O-CG1 3.23Å; Y187-I191 WeakPolarHBondContact O-CG1 3.39Å; Y187-I191 PolarHBondContact O-N 2.88Å; Y187-I191 VanDerWaalsContact O-N 3.12Å
188	E	96.1	Very high	95.5	Very high	40 Å²	40	66.8 Å²	66.8	19%	0.187	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-57.9	-178.5	-175.7	-175.8	155.5	0	0	112.6	V154 K157 L185 C192	V154-E188 HydrophobicContact CG2-CG 3.93Å; K157-E188 WeakPolarHBondContact CD-OE1 3.43Å; K157-E188 IonicContact NZ-OE1 2.69Å; K157-E188 PolarHBondContact NZ-OE1 3.3Å; K157-E188 IonicContact NZ-OE2 3.77Å; K157-E188 PolarHBondContact NZ-OE2 3.41Å; L185-E188 VanDerWaalsContact O-CB 3.31Å; L185-E188 WeakPolarHBondContact O-CB 3.32Å; L185-E188 PolarHBondContact O-N 3.14Å; E188-C192 PolarHBondContact O-N 3.23Å; E188-C192 PolarHBondContact O-SG 2.93Å; E188-C192 VanDerWaalsContact O-SG 3.35Å
189	L	96.7	Very high	95.5	Very high	120 Å²	120	57.7 Å²	57.7	63%	0.628	30%	0.3	S	S	*	.	H	α-helix	trans	-69.9	-41.8	-179.4	-69.5	176.2	0	0	0	113.5	I191 C192 S193	L189-I191 VanDerWaalsContact C-N 3.29Å; L189-I191 PolarHBondContact O-N 3.04Å; L189-C192 WeakPolarHBondContact O-CB 3.17Å; L189-C192 PolarHBondContact O-N 2.81Å; L189-S193 PolarHBondContact O-N 3.12Å
190	P	96.4	Very high	95.5	Very high	32 Å²	32	63.8 Å²	63.8	21%	0.208	33%	0.329	C	S	.	.	H	α-helix	trans	-55.8	-40.7	174.8	-29.3	36	0	0	0	113.5	I6 V8 A186 S193 V194	I6-P190 HydrophobicContact CG2-CB 3.59Å; V8-P190 HydrophobicContact CG2-CG 4.26Å; A186-P190 WeakPolarHBondContact O-CD 3.47Å; A186-P190 VanDerWaalsContact O-CG 3.27Å; A186-P190 WeakPolarHBondContact O-CG 3.47Å; P190-S193 WeakPolarHBondContact O-CB 3.3Å; P190-S193 PolarHBondContact O-N 3.08Å; P190-V194 VanDerWaalsContact O-CG2 3.31Å; P190-V194 WeakPolarHBondContact O-CG2 3.37Å; P190-V194 PolarHBondContact O-N 3.06Å
191	I	95.9	Very high	95.3	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-45.5	176.6	-73.4	173.8	0	0	0	111.4	I133 V147 A150 Y187 L189 S193 V194 L195	I133-I191 HydrophobicContact CD1-CB 4.35Å; I133-I191 HydrophobicContact CD1-CD1 4.39Å; I133-I191 HydrophobicContact CD1-CG1 4Å; I133-I191 HydrophobicContact CD1-CG2 3.71Å; V147-I191 HydrophobicContact CB-CD1 4.36Å; V147-I191 HydrophobicContact CG1-CD1 4.01Å; V147-I191 HydrophobicContact CG1-CG1 4.44Å; V147-I191 WeakPolarHBondContact O-CD1 3.46Å; A150-I191 HydrophobicContact CB-CD1 3.41Å; A150-I191 VanDerWaalsContact CB-CD1 3.41Å; Y187-I191 WeakPolarHBondContact O-CB 3.33Å; Y187-I191 VanDerWaalsContact O-CG1 3.23Å; Y187-I191 WeakPolarHBondContact O-CG1 3.39Å; Y187-I191 PolarHBondContact O-N 2.88Å; Y187-I191 VanDerWaalsContact O-N 3.12Å; L189-I191 VanDerWaalsContact C-N 3.29Å; L189-I191 PolarHBondContact O-N 3.04Å; I191-S193 VanDerWaalsContact C-N 3.27Å; I191-S193 PolarHBondContact O-N 2.89Å; I191-V194 PolarHBondContact O-N 3.03Å; I191-L195 HydrophobicContact CG2-CD1 3.82Å; I191-L195 HydrophobicContact CG2-CG 4.42Å; I191-L195 WeakPolarHBondContact O-CB 3.4Å; I191-L195 VanDerWaalsContact O-CG 3.3Å; I191-L195 WeakPolarHBondContact O-CG 3.25Å; I191-L195 PolarHBondContact O-N 3.29Å
192	C	96.8	Very high	95.3	Very high	11 Å²	11	60.3 Å²	60.3	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-41.7	175.3	-65.5	0	0	0	0	111.7	E188 L189 L195 Q196 F197 L199	E188-C192 PolarHBondContact O-N 3.23Å; E188-C192 PolarHBondContact O-SG 2.93Å; E188-C192 VanDerWaalsContact O-SG 3.35Å; L189-C192 WeakPolarHBondContact O-CB 3.17Å; L189-C192 PolarHBondContact O-N 2.81Å; C192-L195 CarbonylContact O-C 3.51Å; C192-L195 PolarHBondContact O-N 3.37Å; C192-Q196 PolarHBondContact O-N 3.18Å; C192-F197 HydrophobicContact CB-CD1 3.93Å; C192-F197 HydrophobicContact CB-CE1 3.69Å; C192-F197 HydrophobicContact CB-CZ 4.25Å; C192-F197 PolarHBondContact O-N 2.96Å; C192-L199 HydrophobicContact CB-CD1 4.47Å
193	S	96.6	Very high	95.2	Very high	73 Å²	73	62.3 Å²	62.3	51%	0.51	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-45.3	176.7	178.3	0	0	0	0	112.4	L189 P190 I191 L195 Q196	L189-S193 PolarHBondContact O-N 3.12Å; P190-S193 WeakPolarHBondContact O-CB 3.3Å; P190-S193 PolarHBondContact O-N 3.08Å; I191-S193 VanDerWaalsContact C-N 3.27Å; I191-S193 PolarHBondContact O-N 2.89Å; S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.39Å; S193-Q196 WeakPolarHBondContact O-CA 3.44Å; S193-Q196 PolarHBondContact O-N 3.14Å
194	V	95.1	Very high	95.1	Very high	28 Å²	28	65.3 Å²	65.3	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-37.9	175.3	166.7	0	0	0	0	111.5	I6 I133 K136 L138 P190 I191 Q196	I6-V194 HydrophobicContact CD1-CG2 4.29Å; I6-V194 HydrophobicContact CG1-CG2 4.07Å; I133-V194 HydrophobicContact CG1-CG1 4Å; I133-V194 HydrophobicContact CG2-CG1 4.49Å; K136-V194 HydrophobicContact CD-CG1 3.9Å; K136-V194 PolarHBondContact NZ-O 3.19Å; L138-V194 HydrophobicContact CD1-CB 4.35Å; L138-V194 HydrophobicContact CD1-CG1 3.47Å; L138-V194 VanDerWaalsContact CD1-CG1 3.47Å; L138-V194 HydrophobicContact CD1-CG2 3.85Å; P190-V194 VanDerWaalsContact O-CG2 3.31Å; P190-V194 WeakPolarHBondContact O-CG2 3.37Å; P190-V194 PolarHBondContact O-N 3.06Å; I191-V194 PolarHBondContact O-N 3.03Å; V194-Q196 PolarHBondContact O-N 2.95Å
195	L	94.5	Very high	95.1	Very high	10 Å²	10	66.3 Å²	66.3	5%	0.052	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	4.1	174.2	-64.5	172.5	0	0	0	113	Y129 K132 I133 I191 C192 S193 F197 R198 L199	Y129-L195 HydrophobicContact CD1-CD1 3.68Å; Y129-L195 HydrophobicContact CD2-CD1 4.45Å; Y129-L195 HydrophobicContact CE1-CD1 4.37Å; Y129-L195 HydrophobicContact CG-CD1 3.74Å; K132-L195 HydrophobicContact CB-CD2 3.85Å; K132-L195 HydrophobicContact CD-CD2 4.34Å; I133-L195 HydrophobicContact CG1-CD2 4.24Å; I191-L195 HydrophobicContact CG2-CD1 3.82Å; I191-L195 HydrophobicContact CG2-CG 4.42Å; I191-L195 WeakPolarHBondContact O-CB 3.4Å; I191-L195 VanDerWaalsContact O-CG 3.3Å; I191-L195 WeakPolarHBondContact O-CG 3.25Å; I191-L195 PolarHBondContact O-N 3.29Å; C192-L195 CarbonylContact O-C 3.51Å; C192-L195 PolarHBondContact O-N 3.37Å; S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.39Å; L195-F197 PolarHBondContact O-N 3.17Å; L195-F197 VanDerWaalsContact O-N 3.14Å; L195-R198 WeakPolarHBondContact O-CB 3.46Å; L195-R198 PolarHBondContact O-N 2.92Å; L195-L199 HydrophobicContact CB-CD2 4.25Å; L195-L199 HydrophobicContact CD1-CD2 3.75Å
196	Q	94.9	Very high	95	Very high	116 Å²	116	62.7 Å²	62.7	54%	0.542	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	32.7	-176.8	-59.2	174.6	-18	0	0	112.5	C192 S193 V194 R198	C192-Q196 PolarHBondContact O-N 3.18Å; S193-Q196 WeakPolarHBondContact O-CA 3.44Å; S193-Q196 PolarHBondContact O-N 3.14Å; V194-Q196 PolarHBondContact O-N 2.95Å; Q196-R198 PolarHBondContact O-N 3.42Å
197	F	95.1	Very high	94.9	Very high	136 Å²	136	64.8 Å²	64.8	60%	0.596	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	18.2	-174.7	-62.8	-91.4	0	0	0	114.8	C192 L195 L199	C192-F197 HydrophobicContact CB-CD1 3.93Å; C192-F197 HydrophobicContact CB-CE1 3.69Å; C192-F197 HydrophobicContact CB-CZ 4.25Å; C192-F197 PolarHBondContact O-N 2.96Å; L195-F197 PolarHBondContact O-N 3.17Å; L195-F197 VanDerWaalsContact O-N 3.14Å; F197-L199 PolarHBondContact O-N 2.92Å
198	R	93.9	Very high	94.8	Very high	133 Å²	133	64.6 Å²	64.6	50%	0.502	33%	0.327	S	S	.	.			trans	-81.4	68.9	171.1	-62.1	-176.4	-177.2	172.2	-0.6	110.2	D44 L195 Q196 Q200	D44-R198 VanDerWaalsContact CG-NH1 3.26Å; D44-R198 IonicContact OD1-NH1 3.71Å; D44-R198 PolarHBondContact OD1-NH1 2.92Å; D44-R198 IonicContact OD2-CZ 2.65Å; D44-R198 IonicContact OD2-NH1 3.76Å; D44-R198 PolarHBondContact OD2-NH1 3.35Å; D44-R198 IonicContact OD2-NH2 2.62Å; L195-R198 WeakPolarHBondContact O-CB 3.46Å; L195-R198 PolarHBondContact O-N 2.92Å; Q196-R198 PolarHBondContact O-N 3.42Å; R198-Q200 VanDerWaalsContact C-N 3.29Å; R198-Q200 PolarHBondContact O-N 3.21Å
199	L	94.3	Very high	94.8	Very high	19 Å²	19	62.9 Å²	62.9	10%	0.099	32%	0.319	C	S	.	.			trans	-91.8	24.7	-174.4	-56.3	178.4	0	0	0	113.5	Y129 V154 M158 C192 L195 F197	Y129-L199 HydrophobicContact CE1-CD2 4.42Å; Y129-L199 PolarHBondContact OH-O 3.47Å; V154-L199 HydrophobicContact CG1-CD1 4.02Å; V154-L199 HydrophobicContact CG1-CD2 3.94Å; M158-L199 HydrophobicContact CE-CB 3.82Å; M158-L199 HydrophobicContact CE-CD1 4.36Å; M158-L199 HydrophobicContact CG-CB 3.97Å; M158-L199 HydrophobicContact CG-CD1 4.04Å; M158-L199 HydrophobicContact SD-CB 3.96Å; M158-L199 HydrophobicContact SD-CD1 3.55Å; M158-L199 VanDerWaalsContact SD-CD1 3.55Å; M158-L199 HydrophobicContact SD-CG 4.42Å; C192-L199 HydrophobicContact CB-CD1 4.47Å; L195-L199 HydrophobicContact CB-CD2 4.25Å; L195-L199 HydrophobicContact CD1-CD2 3.75Å; F197-L199 PolarHBondContact O-N 2.92Å
200	Q	93.4	Very high	94.7	Very high	172 Å²	172	57.8 Å²	57.8	80%	0.804	29%	0.293	S	S	*	.			trans	-134.1	82.6	174.7	-70.4	-176.2	-41.8	0	0	107.5	R198	R198-Q200 VanDerWaalsContact C-N 3.29Å; R198-Q200 PolarHBondContact O-N 3.21Å
201	P	92.4	Very high	94.6	Very high	12 Å²	12	59.5 Å²	59.5	8%	0.078	30%	0.301	C	S	.	.			trans	-62.4	153.5	175.8	-14.8	28.7	0	0	0	110.6	T125 V128 Y129 E205 I206	T125-P201 HydrophobicContact CG2-CG 4.17Å; V128-P201 HydrophobicContact CB-CB 4.47Å; V128-P201 HydrophobicContact CB-CG 4.26Å; V128-P201 HydrophobicContact CG1-CB 3.86Å; V128-P201 HydrophobicContact CG1-CG 3.9Å; Y129-P201 HydrophobicContact CD1-CG 4.27Å; Y129-P201 HydrophobicContact CE1-CG 3.59Å; P201-E205 VanDerWaalsContact CA-OE2 3.32Å; P201-E205 WeakPolarHBondContact CA-OE2 3.38Å; P201-E205 HydrophobicContact CB-CB 4.31Å; P201-E205 WeakPolarHBondContact CB-OE2 3.27Å; P201-I206 HydrophobicContact CB-CD1 3.91Å; P201-I206 HydrophobicContact CB-CG1 3.91Å; P201-I206 HydrophobicContact CG-CD1 4.31Å; P201-I206 HydrophobicContact CG-CG1 4.48Å
202	T	94.1	Very high	94.4	Very high	77 Å²	77	63.3 Å²	63.3	47%	0.472	32%	0.315	S	S	.	.			trans	-73.2	161.9	178.5	64.2	0	0	0	0	111	D204 E205 I206	T202-D204 PolarHBondContact O-N 2.95Å; T202-E205 PolarHBondContact N-OE2 2.84Å; T202-E205 PolarHBondContact O-N 3.43Å; T202-E205 WeakPolarHBondContact OG1-CG 3.33Å; T202-E205 PolarHBondContact OG1-OE2 2.99Å; T202-I206 WeakPolarHBondContact O-CG1 3.1Å; T202-I206 PolarHBondContact O-N 3.44Å
203	I	93.8	Very high	94.2	Very high	113 Å²	113	62.9 Å²	62.9	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-60.1	-38.7	178.7	-63.1	172.2	0	0	0	110.6	E205 I206 Q207	I203-E205 VanDerWaalsContact C-N 3.25Å; I203-E205 PolarHBondContact O-N 3.39Å; I203-I206 PolarHBondContact O-N 3.3Å; I203-I206 VanDerWaalsContact O-N 3.08Å; I203-Q207 HydrophobicContact CG2-CB 4.49Å; I203-Q207 VanDerWaalsContact O-CB 3.3Å; I203-Q207 WeakPolarHBondContact O-CB 3.35Å; I203-Q207 PolarHBondContact O-N 3.12Å
204	D	93.1	Very high	93.9	Very high	131 Å²	131	64.8 Å²	64.8	70%	0.701	31%	0.313	S	S	*	.	H	α-helix	trans	-62.1	-33.5	179.5	-61	-44.4	0	0	0	112.5	T202 P208	T202-D204 PolarHBondContact O-N 2.95Å; D204-P208 WeakPolarHBondContact O-CD 3.48Å
205	E	94	Very high	93.5	Very high	26 Å²	26	71.9 Å²	71.9	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-74	-31.9	175.9	-65.9	177.6	120.9	0	0	112.4	Y46 P48 V128 K132 P201 T202 I203 H209	Y46-E205 HydrophobicContact CD1-CB 4.06Å; Y46-E205 HydrophobicContact CD1-CG 3.77Å; Y46-E205 WeakPolarHBondContact CD1-OE1 3.49Å; Y46-E205 HydrophobicContact CE1-CB 3.96Å; Y46-E205 HydrophobicContact CE1-CG 4.19Å; P48-E205 WeakPolarHBondContact CB-O 3.33Å; V128-E205 HydrophobicContact CG1-CB 4.48Å; V128-E205 WeakPolarHBondContact CG2-O 3.36Å; K132-E205 WeakPolarHBondContact CE-OE1 3.43Å; K132-E205 VanDerWaalsContact NZ-CD 3.35Å; K132-E205 IonicContact NZ-OE1 3.23Å; K132-E205 PolarHBondContact NZ-OE1 3.4Å; K132-E205 IonicContact NZ-OE2 3.86Å; K132-E205 PolarHBondContact NZ-OE2 3.08Å; P201-E205 VanDerWaalsContact CA-OE2 3.32Å; P201-E205 WeakPolarHBondContact CA-OE2 3.38Å; P201-E205 HydrophobicContact CB-CB 4.31Å; P201-E205 WeakPolarHBondContact CB-OE2 3.27Å; T202-E205 PolarHBondContact N-OE2 2.84Å; T202-E205 PolarHBondContact O-N 3.43Å; T202-E205 WeakPolarHBondContact OG1-CG 3.33Å; T202-E205 PolarHBondContact OG1-OE2 2.99Å; I203-E205 VanDerWaalsContact C-N 3.25Å; I203-E205 PolarHBondContact O-N 3.39Å; E205-H209 PolarHBondContact O-CD2 3.1Å; E205-H209 VanDerWaalsContact O-CD2 3.26Å
206	I	95.6	Very high	92.8	Very high	1 Å²	1	77.9 Å²	77.9	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-90.8	-41.1	-172.5	-64.6	169.3	0	0	0	111.7	Y121 A124 V128 P201 T202 I203 P208 H209 V210	Y121-I206 HydrophobicContact CD2-CG2 3.76Å; Y121-I206 HydrophobicContact CE1-CD1 4.33Å; Y121-I206 HydrophobicContact CE2-CB 4.34Å; Y121-I206 HydrophobicContact CE2-CD1 3.94Å; Y121-I206 HydrophobicContact CE2-CG2 3.62Å; Y121-I206 VanDerWaalsContact OH-CD1 3.27Å; Y121-I206 WeakPolarHBondContact OH-CD1 3.4Å; A124-I206 HydrophobicContact CB-CG2 3.84Å; V128-I206 HydrophobicContact CG2-CG1 4.23Å; P201-I206 HydrophobicContact CB-CD1 3.91Å; P201-I206 HydrophobicContact CB-CG1 3.91Å; P201-I206 HydrophobicContact CG-CD1 4.31Å; P201-I206 HydrophobicContact CG-CG1 4.48Å; T202-I206 WeakPolarHBondContact O-CG1 3.1Å; T202-I206 PolarHBondContact O-N 3.44Å; I203-I206 PolarHBondContact O-N 3.3Å; I203-I206 VanDerWaalsContact O-N 3.08Å; I206-P208 VanDerWaalsContact C-CD 3.47Å; I206-H209 WeakPolarHBondContact O-CB 3.12Å; I206-H209 PolarHBondContact O-N 3.37Å; I206-V210 HydrophobicContact CG2-CG2 3.68Å; I206-V210 PolarHBondContact O-N 3.15Å; I206-V210 VanDerWaalsContact O-N 3.08Å
207	Q	94.7	Very high	92.1	Very high	82 Å²	82	76.3 Å²	76.3	38%	0.383	36%	0.363	S	S	.	.	H	α-helix	trans	-53.7	-44.5	-171	-169.3	65.6	45.6	0	0	113.4	I203 H209 V210 D211	I203-Q207 HydrophobicContact CG2-CB 4.49Å; I203-Q207 VanDerWaalsContact O-CB 3.3Å; I203-Q207 WeakPolarHBondContact O-CB 3.35Å; I203-Q207 PolarHBondContact O-N 3.12Å; Q207-H209 PolarHBondContact O-N 3.05Å; Q207-V210 PolarHBondContact O-N 3.06Å; Q207-V210 VanDerWaalsContact O-N 3.12Å; Q207-D211 PolarHBondContact NE2-OD1 2.93Å; Q207-D211 VanDerWaalsContact O-CG 3.31Å; Q207-D211 PolarHBondContact O-N 2.94Å
208	P	93.9	Very high	92	Very high	25 Å²	25	73.4 Å²	73.4	16%	0.162	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-26.5	179.1	-23.4	36	0	0	0	113.7	P48 I49 D204 I206 R212	P48-P208 HydrophobicContact CB-CB 4.33Å; P48-P208 HydrophobicContact CB-CG 3.99Å; P48-P208 HydrophobicContact CG-CG 3.88Å; I49-P208 HydrophobicContact CG1-CB 4.26Å; I49-P208 HydrophobicContact CG1-CG 4.44Å; D204-P208 WeakPolarHBondContact O-CD 3.48Å; I206-P208 VanDerWaalsContact C-CD 3.47Å; P208-R212 WeakPolarHBondContact O-CG 3.26Å
209	H	95.1	Very high	91.9	Very high	3 Å²	3	70.2 Å²	70.2	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-80.4	-38.9	175.2	-64	-67.7	0	0	0	111.4	Y46 K106 A124 Y127 E131 E205 I206 Q207 R212 L213	Y46-H209 PolarHBondContact OH-NE2 2.97Å; K106-H209 PolarHBondContact NZ-CE1 2.77Å; K106-H209 PolarHBondContact NZ-ND1 3.3Å; A124-H209 HydrophobicContact CB-CB 3.87Å; Y127-H209 HydrophobicContact CD2-CB 4.35Å; E131-H209 IonicContact OE2-CE1 3.06Å; E131-H209 PolarHBondContact OE2-CE1 3.41Å; E131-H209 IonicContact OE2-NE2 2.68Å; E131-H209 PolarHBondContact OE2-NE2 3.21Å; E205-H209 PolarHBondContact O-CD2 3.1Å; E205-H209 VanDerWaalsContact O-CD2 3.26Å; I206-H209 WeakPolarHBondContact O-CB 3.12Å; I206-H209 PolarHBondContact O-N 3.37Å; Q207-H209 PolarHBondContact O-N 3.05Å; H209-R212 PolarHBondContact O-N 3.07Å; H209-L213 WeakPolarHBondContact O-CB 3.42Å; H209-L213 VanDerWaalsContact O-CG 3.32Å; H209-L213 WeakPolarHBondContact O-CG 3.36Å; H209-L213 PolarHBondContact O-N 3.17Å
210	V	95.4	Very high	91.8	Very high	13 Å²	13	73.1 Å²	73.1	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-50	174.3	172.7	0	0	0	0	110.5	V120 Y121 A124 I206 Q207 R212 L213 Q214	V120-V210 HydrophobicContact CG1-CG1 4.19Å; Y121-V210 HydrophobicContact CD2-CG2 4.31Å; A124-V210 HydrophobicContact CB-CG2 3.54Å; I206-V210 HydrophobicContact CG2-CG2 3.68Å; I206-V210 PolarHBondContact O-N 3.15Å; I206-V210 VanDerWaalsContact O-N 3.08Å; Q207-V210 PolarHBondContact O-N 3.06Å; Q207-V210 VanDerWaalsContact O-N 3.12Å; V210-R212 PolarHBondContact O-N 3.04Å; V210-L213 PolarHBondContact O-N 2.8Å; V210-L213 VanDerWaalsContact O-N 3.17Å; V210-Q214 HydrophobicContact CG1-CG 4.29Å; V210-Q214 WeakPolarHBondContact O-CG 2.97Å; V210-Q214 PolarHBondContact O-N 3.34Å
211	D	93.6	Very high	91.7	Very high	69 Å²	69	67.2 Å²	67.2	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-37	-178.6	-66.8	-15.2	0	0	0	111.5	Q207 F215	Q207-D211 PolarHBondContact NE2-OD1 2.93Å; Q207-D211 VanDerWaalsContact O-CG 3.31Å; Q207-D211 PolarHBondContact O-N 2.94Å; D211-F215 WeakPolarHBondContact O-CD2 3.34Å; D211-F215 WeakPolarHBondContact O-CE2 3.46Å
212	R	91.1	Very high	91.6	Very high	80 Å²	80	70.7 Å²	70.7	30%	0.302	35%	0.347	S	S	.	.	H	α-helix	trans	-73.5	-47.8	176.3	-68.8	179.2	-170.2	125.4	3.4	112.1	S52 P208 H209 V210 Q214 F215 E216	S52-R212 PolarHBondContact OG-NH1 3.26Å; S52-R212 PolarHBondContact OG-NH2 2.92Å; P208-R212 WeakPolarHBondContact O-CG 3.26Å; H209-R212 PolarHBondContact O-N 3.07Å; V210-R212 PolarHBondContact O-N 3.04Å; R212-Q214 PolarHBondContact O-N 2.88Å; R212-F215 PolarHBondContact O-N 2.98Å; R212-E216 PolarHBondContact O-N 2.89Å
213	L	93.6	Very high	91.4	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-62.5	-31.1	-178.2	-77.3	169	0	0	0	112.4	A110 V120 V123 A124 Y127 H209 V210 F215 E216 M217	A110-L213 HydrophobicContact CB-CD2 4.02Å; V120-L213 HydrophobicContact CG1-CB 3.6Å; V120-L213 HydrophobicContact CG1-CD1 4.32Å; V123-L213 HydrophobicContact CB-CD1 4.14Å; V123-L213 HydrophobicContact CG1-CD1 3.85Å; V123-L213 HydrophobicContact CG1-CD2 4.31Å; A124-L213 HydrophobicContact CB-CD1 3.94Å; Y127-L213 HydrophobicContact CD2-CD1 4.12Å; Y127-L213 HydrophobicContact CE2-CD1 3.91Å; Y127-L213 HydrophobicContact CE2-CD2 3.67Å; Y127-L213 HydrophobicContact CE2-CG 3.93Å; H209-L213 WeakPolarHBondContact O-CB 3.42Å; H209-L213 VanDerWaalsContact O-CG 3.32Å; H209-L213 WeakPolarHBondContact O-CG 3.36Å; H209-L213 PolarHBondContact O-N 3.17Å; V210-L213 PolarHBondContact O-N 2.8Å; V210-L213 VanDerWaalsContact O-N 3.17Å; L213-F215 PolarHBondContact O-N 2.93Å; L213-F215 VanDerWaalsContact O-N 3.15Å; L213-E216 PolarHBondContact O-N 3.07Å; L213-M217 HydrophobicContact CB-SD 4.22Å; L213-M217 HydrophobicContact CD2-CG 4.15Å; L213-M217 HydrophobicContact CD2-SD 3.92Å; L213-M217 HydrophobicContact CG-SD 4.48Å; L213-M217 WeakPolarHBondContact O-CB 3.41Å; L213-M217 PolarHBondContact O-N 3.34Å
214	Q	90.7	Very high	91.3	Very high	113 Å²	113	67.2 Å²	67.2	53%	0.528	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-23.5	173.9	-78.7	178.7	-8.9	0	0	114.1	V120 V210 R212	V120-Q214 HydrophobicContact CG1-CG 4.48Å; V210-Q214 HydrophobicContact CG1-CG 4.29Å; V210-Q214 WeakPolarHBondContact O-CG 2.97Å; V210-Q214 PolarHBondContact O-N 3.34Å; R212-Q214 PolarHBondContact O-N 2.88Å
215	F	86.6	Confident	91.1	Very high	177 Å²	177	62.3 Å²	62.3	78%	0.776	29%	0.292	S	S	*	.	H	α-helix	trans	-96.6	-13.3	175	-59.5	-72.9	0	0	0	113	D211 R212 L213	D211-F215 WeakPolarHBondContact O-CD2 3.34Å; D211-F215 WeakPolarHBondContact O-CE2 3.46Å; R212-F215 PolarHBondContact O-N 2.98Å; L213-F215 PolarHBondContact O-N 2.93Å; L213-F215 VanDerWaalsContact O-N 3.15Å
216	E	79.5	Confident	90.9	Very high	137 Å²	137	65.3 Å²	65.3	64%	0.64	31%	0.306	S	S	*	.	H	α-helix	trans	-104.1	-29.2	-175.2	-66.6	-177.7	171.6	0	0	113.5	R212 L213	R212-E216 PolarHBondContact O-N 2.89Å; L213-E216 PolarHBondContact O-N 3.07Å
217	M	81.2	Confident	90.5	Very high	83 Å²	83	71.2 Å²	71.2	41%	0.409	33%	0.333	S	S	.	.			trans	-101.4	0	178.7	-66.8	178.5	66.9	0	0	111.7	A110 V114 V120 V123 L213	A110-M217 HydrophobicContact CB-CG 4.24Å; A110-M217 HydrophobicContact CB-SD 4.41Å; V114-M217 HydrophobicContact CG2-CB 3.99Å; V114-M217 HydrophobicContact CG2-CE 3.6Å; V114-M217 HydrophobicContact CG2-CG 3.92Å; V120-M217 HydrophobicContact CG2-CE 4.34Å; V120-M217 HydrophobicContact CG2-SD 4.13Å; V123-M217 HydrophobicContact CB-SD 4.32Å; V123-M217 HydrophobicContact CG1-SD 4.29Å; V123-M217 HydrophobicContact CG2-CE 4.02Å; V123-M217 HydrophobicContact CG2-SD 4.27Å; L213-M217 HydrophobicContact CB-SD 4.22Å; L213-M217 HydrophobicContact CD2-CG 4.15Å; L213-M217 HydrophobicContact CD2-SD 3.92Å; L213-M217 HydrophobicContact CG-SD 4.48Å; L213-M217 WeakPolarHBondContact O-CB 3.41Å; L213-M217 PolarHBondContact O-N 3.34Å

Retrieved 217 of 217 residues in 172.5 ms (Link to these results)

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