A0A077Z653_TRITR Loading...

Cyclin N domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z653, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 451 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	33.5	Very low	36.5	Very low	221 Å²	221	162.1 Å²	162.1	100%	1.089	78%	0.784	S	S	*	*				0	92.9	0	-86.3	179.8	-91.1	0	0	106.6
2	R	31.9	Very low	36.1	Very low	224 Å²	224	158.6 Å²	158.6	85%	0.845	78%	0.78	S	S	*	*				89.1	81.8	117.3	-73	-173.8	-179.8	179.2	0.9	111.2
3	E	33.7	Very low	35.7	Very low	152 Å²	152	160.7 Å²	160.7	71%	0.71	78%	0.782	S	S	*	*	S	Bend	trans	-175.9	-4.2	146	-105.8	170.6	-162	0	0	117.6	A5	E3-A5 VanDerWaalsContact C-N 3.34Å; E3-A5 PolarHBondContact O-N 2.76Å
4	Y	40.3	Very low	35.4	Very low	237 Å²	237	161.1 Å²	161.1	93%	0.929	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	22.9	177.8	-67	-74.1	0	0	0	116
5	A	39.1	Very low	35.1	Very low	69 Å²	69	158.1 Å²	158.1	57%	0.57	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-7	-173.1	0	0	0	0	0	115.4	E3	E3-A5 VanDerWaalsContact C-N 3.34Å; E3-A5 PolarHBondContact O-N 2.76Å
6	W	36.9	Very low	34.7	Very low	207 Å²	207	159.7 Å²	159.7	78%	0.784	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-1.2	-167.1	-78	96.6	0	0	0	116.9
7	L	41.2	Very low	34.5	Very low	183 Å²	183	156.3 Å²	156.3	96%	0.958	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	8.7	177.1	-78.2	168.1	0	0	0	114.5
8	C	40	Very low	34.7	Very low	108 Å²	108	157.8 Å²	157.8	73%	0.73	79%	0.785	S	S	*	*	S	Bend	trans	-127.6	6.5	-173.7	-142	0	0	0	0	115.5
9	E	34	Very low	34.6	Very low	137 Å²	137	160.1 Å²	160.1	64%	0.64	79%	0.793	S	S	*	*			trans	-97.7	-5.7	-169.9	-94.7	-172.1	164.9	0	0	117	C11	E9-C11 VanDerWaalsContact C-N 3.28Å; E9-C11 PolarHBondContact O-N 3.29Å
10	L	38.1	Very low	34.7	Very low	186 Å²	186	155.6 Å²	155.6	97%	0.974	79%	0.789	S	S	*	*	S	Bend	trans	-88.2	13.9	179.2	-91.4	157.3	0	0	0	114.7
11	C	33.3	Very low	35	Very low	59 Å²	59	151.9 Å²	151.9	40%	0.399	78%	0.782	S	S	.	*			trans	-137.3	36.6	-167	-118	0	0	0	0	112.6	E9 R32	E9-C11 VanDerWaalsContact C-N 3.28Å; E9-C11 PolarHBondContact O-N 3.29Å; C11-R32 VanDerWaalsContact CB-NH1 3.32Å; C11-R32 PolarHBondContact O-NH1 3.46Å; C11-R32 PolarHBondContact O-NH2 3.3Å; C11-R32 PolarHBondContact SG-NE 3.42Å; C11-R32 PolarHBondContact SG-NH2 3.17Å
12	V	31.5	Very low	35.2	Very low	120 Å²	120	147.1 Å²	147.1	73%	0.727	77%	0.771	S	S	*	*			trans	-131.7	71.9	175.8	-172.2	0	0	0	0	110.4
13	K	31.2	Very low	35.6	Very low	186 Å²	186	145.3 Å²	145.3	81%	0.809	77%	0.769	S	S	*	*			trans	-152.6	132.8	157.4	-74.7	-163.4	174.7	166.9	0	110.9
14	M	31.2	Very low	35.9	Very low	166 Å²	166	146.1 Å²	146.1	82%	0.818	77%	0.771	S	S	*	*			trans	78.6	97.1	164.1	-63.5	-172.4	-99.1	0	0	116.4
15	T	30.9	Very low	36.4	Very low	117 Å²	117	143.6 Å²	143.6	72%	0.718	77%	0.773	S	S	*	*				92.8	108.8	67.3	52.4	0	0	0	0	112.5
16	E	28.1	Very low	36.8	Very low	183 Å²	183	145.3 Å²	145.3	86%	0.855	77%	0.772	S	S	*	*			trans	51.8	140.4	135	-63.7	173.8	173.3	0	0	121.7
17	S	31	Very low	37.4	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	75%	0.753	S	S	*	*			trans	83.8	133.8	179.2	109.2	0	0	0	0	113.4
18	E	39	Very low	37.7	Very low	183 Å²	183	137.3 Å²	137.3	86%	0.855	74%	0.744	S	S	*	*			cis	-167.2	147.8	23.3	-124.5	157.2	-144.3	0	0	110.1
19	E	31.8	Very low	38	Very low	202 Å²	202	139.1 Å²	139.1	94%	0.944	75%	0.745	S	S	*	*			trans	-68.5	122.6	175.2	-63.5	169	140.9	0	0	110.8
20	G	37.7	Very low	38.5	Very low	70 Å²	70	141 Å²	141	72%	0.722	75%	0.748	S	S	*	*			trans	176.1	-13.2	174.4	0	0	0	0	0	119.4	S22	G20-S22 VanDerWaalsContact C-N 3.3Å; G20-S22 PolarHBondContact O-N 3.38Å; G20-S22 VanDerWaalsContact O-N 3.1Å
21	A	40.5	Very low	39.1	Very low	77 Å²	77	143.2 Å²	143.2	64%	0.636	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-77.5	4.8	-165.7	0	0	0	0	0	117	K23	A21-K23 VanDerWaalsContact C-N 3.34Å; A21-K23 PolarHBondContact O-N 3.32Å
22	S	38	Very low	40.4	Very low	121 Å²	121	148.5 Å²	148.5	85%	0.846	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-82.3	5.3	-171.2	-169.8	0	0	0	0	116	G20	G20-S22 VanDerWaalsContact C-N 3.3Å; G20-S22 PolarHBondContact O-N 3.38Å; G20-S22 VanDerWaalsContact O-N 3.1Å
23	K	41.3	Very low	41.9	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-111.6	-3.7	-173.3	-83.9	-176.4	177.6	177	0	116.7	A21	A21-K23 VanDerWaalsContact C-N 3.34Å; A21-K23 PolarHBondContact O-N 3.32Å
24	F	39.4	Very low	43.6	Very low	170 Å²	170	145.6 Å²	145.6	75%	0.746	74%	0.738	S	S	*	*	S	Bend	trans	-135.7	151.6	174.5	-69.5	-86.2	0	0	0	108.3	L26	F24-L26 HydrophobicContact CB-CD1 3.98Å; F24-L26 HydrophobicContact CB-CG 4.31Å; F24-L26 PolarHBondContact O-N 3.16Å
25	N	50.4	Low	45.3	Very low	183 Å²	183	143.6 Å²	143.6	98%	0.979	73%	0.73	S	S	*	*			trans	-64.4	58.7	173.9	-76.3	-60.1	0	0	0	111.3
26	L	48.5	Very low	47.5	Very low	105 Å²	105	140.1 Å²	140.1	55%	0.55	71%	0.711	S	S	.	*			trans	-85.5	147.3	172.5	-78.5	151.8	0	0	0	108.1	F24 Q28	F24-L26 HydrophobicContact CB-CD1 3.98Å; F24-L26 HydrophobicContact CB-CG 4.31Å; F24-L26 PolarHBondContact O-N 3.16Å; L26-Q28 PolarHBondContact O-N 3.43Å; L26-Q28 VanDerWaalsContact O-N 3.08Å
27	P	48.3	Very low	49.9	Very low	60 Å²	60	137.2 Å²	137.2	39%	0.39	70%	0.701	S	S	.	*			trans	-50.9	119.7	176.3	-22.5	31.5	0	0	0	109.9	L29 E34	P27-L29 PolarHBondContact O-N 3.34Å; P27-L29 VanDerWaalsContact O-N 3.14Å; P27-E34 HydrophobicContact CB-CG 4.38Å
28	Q	48.4	Very low	52.4	Low	162 Å²	162	138.8 Å²	138.8	76%	0.757	70%	0.697	S	S	*	*			trans	-66.4	115.4	174	-73.1	-175.2	-2.8	0	0	108.2	L26 Y30	L26-Q28 PolarHBondContact O-N 3.43Å; L26-Q28 VanDerWaalsContact O-N 3.08Å; Q28-Y30 VanDerWaalsContact C-N 3.29Å; Q28-Y30 PolarHBondContact O-N 2.74Å
29	L	46.3	Very low	54.4	Low	146 Å²	146	130.7 Å²	130.7	76%	0.764	66%	0.659	S	S	*	*			trans	-68	85.5	172	-87.5	155.1	0	0	0	109.6	P27 R31	P27-L29 PolarHBondContact O-N 3.34Å; P27-L29 VanDerWaalsContact O-N 3.14Å; L29-R31 PolarHBondContact O-N 3.32Å
30	Y	44.1	Very low	56.8	Low	178 Å²	178	123.3 Å²	123.3	70%	0.698	63%	0.633	S	S	*	*	B	Isolated β-bridge	trans	-86.6	101.9	168.5	-148.4	-92	0	0	0	108	Q28 R32 I33	Q28-Y30 VanDerWaalsContact C-N 3.29Å; Q28-Y30 PolarHBondContact O-N 2.74Å; Y30-R32 PolarHBondContact O-N 2.99Å; Y30-I33 WeakPolarHBondContact O-CB 3.4Å; Y30-I33 PolarHBondContact O-N 3.05Å
31	R	49.5	Very low	59.2	Low	231 Å²	231	124.2 Å²	124.2	87%	0.872	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	36.7	72.6	177.3	-88.2	-174	176.2	-165.3	0	113.4	L29 I33	L29-R31 PolarHBondContact O-N 3.32Å; R31-I33 PolarHBondContact O-N 3Å
32	R	61.7	Low	61.4	Low	170 Å²	170	122 Å²	122	64%	0.642	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.7	5.6	174.9	-143.7	-170.7	-149.2	135.6	7.3	116.9	C11 Y30	C11-R32 VanDerWaalsContact CB-NH1 3.32Å; C11-R32 PolarHBondContact O-NH1 3.46Å; C11-R32 PolarHBondContact O-NH2 3.3Å; C11-R32 PolarHBondContact SG-NE 3.42Å; C11-R32 PolarHBondContact SG-NH2 3.17Å; Y30-R32 PolarHBondContact O-N 2.99Å
33	I	62.9	Low	63.7	Low	102 Å²	102	119.5 Å²	119.5	52%	0.523	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-95.6	109.3	174	-59.1	166.7	0	0	0	107.1	Y30 R31 L35	Y30-I33 WeakPolarHBondContact O-CB 3.4Å; Y30-I33 PolarHBondContact O-N 3.05Å; R31-I33 PolarHBondContact O-N 3Å; I33-L35 HydrophobicContact CG2-CD2 3.8Å; I33-L35 HydrophobicContact CG2-CG 4.14Å; I33-L35 PolarHBondContact O-N 3.1Å
34	E	66.1	Low	65.8	Low	143 Å²	143	116.7 Å²	116.7	67%	0.668	57%	0.572	S	S	*	*			trans	-81	102.7	170.3	-171.6	176.7	-177.9	0	0	108.7	P27 S36	P27-E34 HydrophobicContact CB-CG 4.38Å; E34-S36 PolarHBondContact O-N 3.32Å; E34-S36 VanDerWaalsContact O-N 3.16Å
35	L	67.4	Low	67.9	Low	125 Å²	125	115.1 Å²	115.1	65%	0.654	57%	0.566	S	S	*	*			trans	-82.1	89.2	173.2	-65.2	176.6	0	0	0	108.8	I33	I33-L35 HydrophobicContact CG2-CD2 3.8Å; I33-L35 HydrophobicContact CG2-CG 4.14Å; I33-L35 PolarHBondContact O-N 3.1Å
36	S	76.8	Confident	69.6	Low	44 Å²	44	113.9 Å²	113.9	31%	0.308	55%	0.548	S	S	.	.			trans	-100.9	144.3	173.4	-174.5	0	0	0	0	111.4	E34 E38	E34-S36 PolarHBondContact O-N 3.32Å; E34-S36 VanDerWaalsContact O-N 3.16Å; S36-E38 WeakPolarHBondContact OG-CB 3.45Å; S36-E38 WeakPolarHBondContact OG-CG 3.49Å; S36-E38 PolarHBondContact OG-N 3.48Å
37	L	78.7	Confident	71.4	Confident	122 Å²	122	109.3 Å²	109.3	64%	0.639	52%	0.524	S	S	*	.	S	Bend	trans	-81.9	0.4	168	-69.2	173.2	0	0	0	111.9	H187 K189	L37-H187 PolarHBondContact O-CD2 3.42Å; L37-K189 WeakPolarHBondContact O-CD 3.47Å; L37-K189 WeakPolarHBondContact O-CE 3.36Å; L37-K189 PolarHBondContact O-NZ 3.25Å; L37-K189 VanDerWaalsContact O-NZ 3.15Å
38	E	83	Confident	73.2	Confident	135 Å²	135	109.8 Å²	109.8	63%	0.631	53%	0.529	S	S	*	.	S	Bend	trans	-73.4	156.5	174.4	-65	179.3	178.1	0	0	111.6	S36 A40	S36-E38 WeakPolarHBondContact OG-CB 3.45Å; S36-E38 WeakPolarHBondContact OG-CG 3.49Å; S36-E38 PolarHBondContact OG-N 3.48Å; E38-A40 PolarHBondContact O-N 2.88Å
39	N	81.3	Confident	75.2	Confident	12 Å²	12	111 Å²	111	6%	0.064	53%	0.526	C	S	.	.			trans	-69.1	130.9	174	-74	-19.7	0	0	0	108.9	I41 K189	N39-I41 PolarHBondContact O-N 3.34Å; N39-K189 PolarHBondContact ND2-O 3.14Å; N39-K189 PolarHBondContact OD1-N 3.33Å
40	A	82.1	Confident	77.3	Confident	48 Å²	48	104.2 Å²	104.2	40%	0.397	49%	0.491	S	S	.	.			trans	-61.7	111.2	173.5	0	0	0	0	0	110.7	E38	E38-A40 PolarHBondContact O-N 2.88Å
41	I	89.1	Confident	79.6	Confident	88 Å²	88	97.1 Å²	97.1	45%	0.451	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-92	132.9	171.7	-62.4	173.6	0	0	0	108	N39 R229	N39-I41 PolarHBondContact O-N 3.34Å; I41-R229 WeakPolarHBondContact CG2-O 3.24Å
42	L	87.2	Confident	81.6	Confident	32 Å²	32	86.1 Å²	86.1	17%	0.168	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-89.4	141.4	-179.1	-62.9	179.7	0	0	0	110.8	L47 Y99 M228	L42-L47 HydrophobicContact CB-CD1 4.27Å; L42-L47 HydrophobicContact CB-CD2 4.06Å; L42-L47 HydrophobicContact CB-CG 3.92Å; L42-L47 HydrophobicContact CD1-CD2 4.14Å; L42-L47 WeakPolarHBondContact O-CD1 3.46Å; L42-Y99 HydrophobicContact CD1-CD1 4.06Å; L42-Y99 HydrophobicContact CD1-CD2 3.98Å; L42-Y99 HydrophobicContact CD1-CG 3.53Å; L42-M228 HydrophobicContact CD1-CB 4.11Å; L42-M228 HydrophobicContact CD1-CG 4.48Å; L42-M228 HydrophobicContact CD1-SD 4.47Å; L42-M228 HydrophobicContact CG-CB 4.39Å; L42-M228 PolarHBondContact N-O 2.92Å
43	P	86.1	Confident	83	Confident	68 Å²	68	80.5 Å²	80.5	44%	0.442	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-57.4	147	170.8	-23	32.8	0	0	0	112.1	E45 R46 L47	P43-E45 VanDerWaalsContact CB-OE2 3.25Å; P43-E45 WeakPolarHBondContact CB-OE2 3.41Å; P43-E45 PolarHBondContact O-N 3.02Å; P43-E45 VanDerWaalsContact O-N 3.15Å; P43-R46 PolarHBondContact O-N 3.5Å; P43-R46 VanDerWaalsContact O-N 3.13Å; P43-L47 PolarHBondContact O-N 3.39Å
44	L	84.8	Confident	84.2	Confident	127 Å²	127	83 Å²	83	67%	0.665	42%	0.419	S	S	*	.	H	α-helix	trans	-56.3	-33.1	-178.6	-101.9	72.1	0	0	0	112.3	L47 S48	L44-L47 PolarHBondContact O-N 2.94Å; L44-S48 WeakPolarHBondContact O-CB 3.48Å; L44-S48 PolarHBondContact O-N 3.37Å
45	E	84	Confident	85.3	Confident	136 Å²	136	76.8 Å²	76.8	64%	0.636	39%	0.391	S	S	*	.	H	α-helix	trans	-61.5	-48.4	179.6	-60.9	72.2	-156	0	0	110.7	P43 L47 S48 R49	P43-E45 VanDerWaalsContact CB-OE2 3.25Å; P43-E45 WeakPolarHBondContact CB-OE2 3.41Å; P43-E45 PolarHBondContact O-N 3.02Å; P43-E45 VanDerWaalsContact O-N 3.15Å; E45-L47 VanDerWaalsContact C-N 3.31Å; E45-L47 PolarHBondContact O-N 2.99Å; E45-S48 PolarHBondContact O-N 2.92Å; E45-S48 PolarHBondContact O-OG 3.08Å; E45-R49 PolarHBondContact O-N 3.16Å
46	R	84.8	Confident	86.4	Confident	158 Å²	158	72.5 Å²	72.5	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-66.1	-35	177.7	-71.7	-164.9	177.4	179	0.6	112.3	P43 S48 R49	P43-R46 PolarHBondContact O-N 3.5Å; P43-R46 VanDerWaalsContact O-N 3.13Å; R46-S48 VanDerWaalsContact C-N 3.31Å; R46-R49 CarbonylContact O-C 3.52Å
47	L	87.1	Confident	87	Confident	9 Å²	9	70.9 Å²	70.9	5%	0.047	36%	0.364	C	S	.	.	H	α-helix	trans	-69.8	-29.9	177.2	-68.9	162.3	0	0	0	112.6	L42 P43 L44 E45 Y99 M228 R229	L42-L47 HydrophobicContact CB-CD1 4.27Å; L42-L47 HydrophobicContact CB-CD2 4.06Å; L42-L47 HydrophobicContact CB-CG 3.92Å; L42-L47 HydrophobicContact CD1-CD2 4.14Å; L42-L47 WeakPolarHBondContact O-CD1 3.46Å; P43-L47 PolarHBondContact O-N 3.39Å; L44-L47 PolarHBondContact O-N 2.94Å; E45-L47 VanDerWaalsContact C-N 3.31Å; E45-L47 PolarHBondContact O-N 2.99Å; L47-Y99 HydrophobicContact CD2-CD1 4.13Å; L47-Y99 HydrophobicContact CD2-CE1 3.66Å; L47-Y99 HydrophobicContact CD2-CE2 4.31Å; L47-M228 HydrophobicContact CD2-CB 3.9Å; L47-R229 HydrophobicContact CD1-CG 3.66Å; L47-R229 HydrophobicContact CD2-CG 4.22Å
48	S	87	Confident	87.6	Confident	69 Å²	69	69.4 Å²	69.4	48%	0.483	36%	0.357	S	S	.	.	H	α-helix	trans	-80	-27.9	-179.7	74.1	0	0	0	0	113.5	L44 E45 R46	L44-S48 WeakPolarHBondContact O-CB 3.48Å; L44-S48 PolarHBondContact O-N 3.37Å; E45-S48 PolarHBondContact O-N 2.92Å; E45-S48 PolarHBondContact O-OG 3.08Å; R46-S48 VanDerWaalsContact C-N 3.31Å
49	R	89	Confident	88	Confident	188 Å²	188	66.2 Å²	66.2	71%	0.709	34%	0.344	S	S	*	.	S	Bend	trans	-129.9	72.9	-178.9	-64.9	-176.9	-174.9	-178.1	1.6	110.4	E45 R46	E45-R49 PolarHBondContact O-N 3.16Å; R46-R49 CarbonylContact O-C 3.52Å
50	P	90.6	Very high	88.4	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.019	37%	0.369	C	S	.	.			trans	-64.9	152.8	175.4	25.9	-33.8	0	0	0	111.6	S52 V53 L59 E62 Y99	P50-S52 PolarHBondContact O-N 3.02Å; P50-V53 HydrophobicContact CG-CG2 3.8Å; P50-V53 WeakPolarHBondContact O-CB 3.3Å; P50-V53 PolarHBondContact O-N 3.45Å; P50-L59 HydrophobicContact CG-CD2 4Å; P50-E62 WeakPolarHBondContact CB-OE1 3.31Å; P50-E62 WeakPolarHBondContact CB-OE2 3.34Å; P50-E62 VanDerWaalsContact CG-CD 3.41Å; P50-E62 WeakPolarHBondContact CG-OE1 3.32Å; P50-E62 WeakPolarHBondContact CG-OE2 3.43Å; P50-Y99 HydrophobicContact CB-CD1 4.41Å; P50-Y99 HydrophobicContact CB-CE1 4.46Å
51	P	91.9	Very high	88.9	Confident	30 Å²	30	69.6 Å²	69.6	20%	0.195	35%	0.352	C	S	.	.	H	α-helix	trans	-58.6	-25.6	-172.9	-26.6	35	0	0	0	115.1	V53 E54 D55 Y99	P51-V53 PolarHBondContact O-N 3.3Å; P51-E54 WeakPolarHBondContact O-CB 3.26Å; P51-E54 PolarHBondContact O-N 2.95Å; P51-D55 PolarHBondContact O-N 3.29Å; P51-Y99 WeakPolarHBondContact CD-O 3.34Å
52	S	91.3	Very high	89	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-69.2	-25.7	179	-33.3	0	0	0	0	112.7	P50 E54 D55 G56 L57 E62 S102 F103	P50-S52 PolarHBondContact O-N 3.02Å; S52-E54 VanDerWaalsContact C-N 3.33Å; S52-D55 CarbonylContact O-C 3.48Å; S52-D55 PolarHBondContact O-N 3.21Å; S52-G56 PolarHBondContact O-N 3.34Å; S52-L57 WeakPolarHBondContact O-CB 3.23Å; S52-L57 PolarHBondContact O-N 3.35Å; S52-E62 VanDerWaalsContact CB-OE2 3.23Å; S52-E62 WeakPolarHBondContact CB-OE2 3.3Å; S52-E62 PolarHBondContact OG-OE2 2.79Å; S52-S102 WeakPolarHBondContact CA-OG 3.18Å; S52-S102 WeakPolarHBondContact OG-CA 3.39Å; S52-F103 WeakPolarHBondContact OG-CD2 3.29Å; S52-F103 PolarHBondContact OG-N 3.27Å
53	V	91.3	Very high	89.3	Confident	51 Å²	51	71.8 Å²	71.8	31%	0.309	35%	0.352	S	S	.	.	H	α-helix	trans	-70.3	-33	175.4	176.8	0	0	0	0	111	P50 P51 D55 G56 L59	P50-V53 HydrophobicContact CG-CG2 3.8Å; P50-V53 WeakPolarHBondContact O-CB 3.3Å; P50-V53 PolarHBondContact O-N 3.45Å; P51-V53 PolarHBondContact O-N 3.3Å; V53-D55 VanDerWaalsContact C-N 3.29Å; V53-D55 PolarHBondContact O-N 2.75Å; V53-G56 VanDerWaalsContact O-CA 3.23Å; V53-G56 WeakPolarHBondContact O-CA 3.33Å; V53-G56 PolarHBondContact O-N 2.9Å; V53-L59 HydrophobicContact CG2-CD2 3.44Å; V53-L59 VanDerWaalsContact CG2-CD2 3.44Å; V53-L59 HydrophobicContact CG2-CG 3.85Å
54	E	89.1	Confident	89.6	Confident	155 Å²	155	70.1 Å²	70.1	72%	0.724	34%	0.34	S	S	*	.	H	α-helix	trans	-65.8	-35.5	173.7	-59.5	-179.4	167.2	0	0	111.1	P51 S52 G56	P51-E54 WeakPolarHBondContact O-CB 3.26Å; P51-E54 PolarHBondContact O-N 2.95Å; S52-E54 VanDerWaalsContact C-N 3.33Å; E54-G56 PolarHBondContact O-N 3.03Å
55	D	89.5	Confident	90	Very high	12 Å²	12	64 Å²	64	6%	0.064	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	4.4	169.7	-66.6	-25.6	0	0	0	112.7	P51 S52 V53 S102 V104 R105 R296	P51-D55 PolarHBondContact O-N 3.29Å; S52-D55 CarbonylContact O-C 3.48Å; S52-D55 PolarHBondContact O-N 3.21Å; V53-D55 VanDerWaalsContact C-N 3.29Å; V53-D55 PolarHBondContact O-N 2.75Å; D55-S102 WeakPolarHBondContact OD2-CB 3.32Å; D55-S102 PolarHBondContact OD2-OG 3.15Å; D55-V104 HydrophobicContact CB-CB 3.96Å; D55-V104 HydrophobicContact CB-CG1 4.3Å; D55-V104 HydrophobicContact CB-CG2 3.83Å; D55-R105 IonicContact OD1-CZ 3.75Å; D55-R105 IonicContact OD1-NE 2.73Å; D55-R105 PolarHBondContact OD1-NE 3.06Å; D55-R105 IonicContact OD1-NH2 3.34Å; D55-R105 PolarHBondContact OD1-NH2 3.44Å; D55-R105 WeakPolarHBondContact OD2-CG 3.36Å; D55-R105 IonicContact OD2-CZ 3.15Å; D55-R105 IonicContact OD2-NE 3.89Å; D55-R105 PolarHBondContact OD2-NE 3.12Å; D55-R105 IonicContact OD2-NH2 3.36Å; D55-R296 VanDerWaalsContact O-CZ 3.25Å; D55-R296 PolarHBondContact O-NE 3.17Å; D55-R296 PolarHBondContact O-NH2 2.68Å
56	G	89.1	Confident	90.6	Very high	35 Å²	35	58 Å²	58	36%	0.361	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	29.7	176.5	0	0	0	0	0	115.5	S52 V53 E54 R296	S52-G56 PolarHBondContact O-N 3.34Å; V53-G56 VanDerWaalsContact O-CA 3.23Å; V53-G56 WeakPolarHBondContact O-CA 3.33Å; V53-G56 PolarHBondContact O-N 2.9Å; E54-G56 PolarHBondContact O-N 3.03Å; G56-R296 VanDerWaalsContact CA-NH2 3.29Å; G56-R296 PolarHBondContact O-NE 3.28Å; G56-R296 VanDerWaalsContact O-NE 3.15Å
57	L	90.6	Very high	91	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.052	26%	0.264	C	S	.	.			trans	-76.9	134.8	163.6	-164.8	70.2	0	0	0	109.9	S52 T61 E62 L65 F103 V104 L293 R296	S52-L57 WeakPolarHBondContact O-CB 3.23Å; S52-L57 PolarHBondContact O-N 3.35Å; L57-T61 HydrophobicContact CD1-CG2 3.96Å; L57-T61 HydrophobicContact CG-CG2 4.36Å; L57-E62 HydrophobicContact CD2-CB 4.11Å; L57-E62 HydrophobicContact CD2-CG 4.37Å; L57-L65 HydrophobicContact CD2-CD1 3.74Å; L57-F103 HydrophobicContact CD2-CB 4.07Å; L57-V104 HydrophobicContact CB-CG2 4.12Å; L57-L293 HydrophobicContact CD1-CD1 4.26Å; L57-L293 HydrophobicContact CD2-CD1 4.35Å; L57-R296 HydrophobicContact CD1-CB 4.45Å; L57-R296 HydrophobicContact CD1-CG 4.45Å
58	D	91.4	Very high	91.3	Very high	91 Å²	91	53.4 Å²	53.4	49%	0.487	26%	0.264	S	S	.	.			trans	-66.3	142.6	176.4	172.6	72	0	0	0	112.1	E60 T61 E62	D58-E60 VanDerWaalsContact C-N 3.31Å; D58-E60 PolarHBondContact O-N 3.49Å; D58-E60 WeakPolarHBondContact OD2-CA 3.25Å; D58-E60 WeakPolarHBondContact OD2-CB 3.23Å; D58-E60 PolarHBondContact OD2-N 3.29Å; D58-T61 WeakPolarHBondContact O-CB 3.43Å; D58-T61 PolarHBondContact O-N 2.97Å; D58-T61 VanDerWaalsContact O-N 3.1Å; D58-T61 PolarHBondContact OD2-N 3.44Å; D58-E62 PolarHBondContact O-N 3.33Å
59	L	91	Very high	91.7	Very high	69 Å²	69	50.1 Å²	50.1	36%	0.361	24%	0.241	S	C	.	.	H	α-helix	trans	-59.9	-36.5	-177.2	-80.9	171.6	0	0	0	113	P50 V53 E62 R63	P50-L59 HydrophobicContact CG-CD2 4Å; V53-L59 HydrophobicContact CG2-CD2 3.44Å; V53-L59 VanDerWaalsContact CG2-CD2 3.44Å; V53-L59 HydrophobicContact CG2-CG 3.85Å; L59-E62 PolarHBondContact O-N 3.31Å; L59-R63 WeakPolarHBondContact O-CB 3.43Å; L59-R63 VanDerWaalsContact O-CG 3.28Å; L59-R63 WeakPolarHBondContact O-CG 3.26Å; L59-R63 PolarHBondContact O-N 2.67Å
60	E	90.2	Very high	92	Very high	123 Å²	123	41.1 Å²	41.1	58%	0.575	21%	0.207	S	C	*	.	H	α-helix	trans	-68.2	-42.8	177	-167.5	-174.2	168.7	0	0	110.1	D58 E62 R63 N64	D58-E60 VanDerWaalsContact C-N 3.31Å; D58-E60 PolarHBondContact O-N 3.49Å; D58-E60 WeakPolarHBondContact OD2-CA 3.25Å; D58-E60 WeakPolarHBondContact OD2-CB 3.23Å; D58-E60 PolarHBondContact OD2-N 3.29Å; E60-E62 VanDerWaalsContact C-N 3.33Å; E60-E62 PolarHBondContact O-N 2.62Å; E60-R63 PolarHBondContact O-N 3.29Å; E60-N64 WeakPolarHBondContact O-CB 3.46Å; E60-N64 VanDerWaalsContact O-CG 3.24Å; E60-N64 PolarHBondContact O-N 3.1Å; E60-N64 PolarHBondContact O-ND2 3.46Å
61	T	91.2	Very high	92.2	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.043	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-40.4	176.8	-57.3	0	0	0	0	111.3	L57 D58 N64 L65 I289 R292	L57-T61 HydrophobicContact CD1-CG2 3.96Å; L57-T61 HydrophobicContact CG-CG2 4.36Å; D58-T61 WeakPolarHBondContact O-CB 3.43Å; D58-T61 PolarHBondContact O-N 2.97Å; D58-T61 VanDerWaalsContact O-N 3.1Å; D58-T61 PolarHBondContact OD2-N 3.44Å; T61-N64 PolarHBondContact O-N 3.07Å; T61-L65 HydrophobicContact CG2-CD1 4.45Å; T61-L65 WeakPolarHBondContact O-CG 3.49Å; T61-L65 PolarHBondContact O-N 2.86Å; T61-I289 HydrophobicContact CG2-CG2 4.5Å; T61-R292 HydrophobicContact CG2-CB 4.46Å
62	E	92.8	Very high	92.3	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.019	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-47	175.4	-164.7	-170	127.5	0	0	112.3	P50 S52 L57 D58 L59 E60 N64 L65 R66 F103	P50-E62 WeakPolarHBondContact CB-OE1 3.31Å; P50-E62 WeakPolarHBondContact CB-OE2 3.34Å; P50-E62 VanDerWaalsContact CG-CD 3.41Å; P50-E62 WeakPolarHBondContact CG-OE1 3.32Å; P50-E62 WeakPolarHBondContact CG-OE2 3.43Å; S52-E62 VanDerWaalsContact CB-OE2 3.23Å; S52-E62 WeakPolarHBondContact CB-OE2 3.3Å; S52-E62 PolarHBondContact OG-OE2 2.79Å; L57-E62 HydrophobicContact CD2-CB 4.11Å; L57-E62 HydrophobicContact CD2-CG 4.37Å; D58-E62 PolarHBondContact O-N 3.33Å; L59-E62 PolarHBondContact O-N 3.31Å; E60-E62 VanDerWaalsContact C-N 3.33Å; E60-E62 PolarHBondContact O-N 2.62Å; E62-N64 VanDerWaalsContact C-N 3.26Å; E62-N64 PolarHBondContact O-N 3.47Å; E62-L65 WeakPolarHBondContact O-CB 3.48Å; E62-L65 PolarHBondContact O-N 3.06Å; E62-L65 VanDerWaalsContact O-N 3.11Å; E62-R66 WeakPolarHBondContact O-CG 3.41Å; E62-R66 PolarHBondContact O-N 3.29Å; E62-R66 IonicContact OE1-CZ 2.75Å; E62-R66 VanDerWaalsContact OE1-CZ 3.25Å; E62-R66 IonicContact OE1-NE 3.17Å; E62-R66 PolarHBondContact OE1-NE 3.48Å; E62-R66 IonicContact OE1-NH2 3.12Å; E62-R66 PolarHBondContact OE1-NH2 3.3Å; E62-F103 HydrophobicContact CG-CD2 3.64Å; E62-F103 HydrophobicContact CG-CE2 3.72Å
63	R	92.4	Very high	92.6	Very high	162 Å²	162	41.7 Å²	41.7	61%	0.611	21%	0.207	S	C	*	.	H	α-helix	trans	-57.9	-41	175.9	-75	172.5	-179.5	172.9	1.4	111.6	L59 E60 R66 F67	L59-R63 WeakPolarHBondContact O-CB 3.43Å; L59-R63 VanDerWaalsContact O-CG 3.28Å; L59-R63 WeakPolarHBondContact O-CG 3.26Å; L59-R63 PolarHBondContact O-N 2.67Å; E60-R63 PolarHBondContact O-N 3.29Å; R63-R66 PolarHBondContact O-N 3.48Å; R63-F67 PolarHBondContact O-N 3.08Å
64	N	92.9	Very high	92.8	Very high	33 Å²	33	39.9 Å²	39.9	18%	0.176	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-37.9	176.3	-73.2	-42.9	0	0	0	112.5	E60 T61 E62 F67 L68 I289	E60-N64 WeakPolarHBondContact O-CB 3.46Å; E60-N64 VanDerWaalsContact O-CG 3.24Å; E60-N64 PolarHBondContact O-N 3.1Å; E60-N64 PolarHBondContact O-ND2 3.46Å; T61-N64 PolarHBondContact O-N 3.07Å; E62-N64 VanDerWaalsContact C-N 3.26Å; E62-N64 PolarHBondContact O-N 3.47Å; N64-F67 PolarHBondContact O-N 2.87Å; N64-L68 VanDerWaalsContact O-CB 3.28Å; N64-L68 WeakPolarHBondContact O-CB 3.46Å; N64-L68 PolarHBondContact O-N 2.98Å; N64-I289 HydrophobicContact CB-CD1 3.78Å; N64-I289 HydrophobicContact CB-CG1 4.27Å
65	L	94	Very high	93.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-42.9	174.1	-77.9	165.8	0	0	0	112.1	L57 T61 E62 L68 G69 F103 F108 I289 L293	L57-L65 HydrophobicContact CD2-CD1 3.74Å; T61-L65 HydrophobicContact CG2-CD1 4.45Å; T61-L65 WeakPolarHBondContact O-CG 3.49Å; T61-L65 PolarHBondContact O-N 2.86Å; E62-L65 WeakPolarHBondContact O-CB 3.48Å; E62-L65 PolarHBondContact O-N 3.06Å; E62-L65 VanDerWaalsContact O-N 3.11Å; L65-L68 PolarHBondContact O-N 2.99Å; L65-G69 PolarHBondContact O-N 3.2Å; L65-F103 HydrophobicContact CB-CD1 3.94Å; L65-F103 HydrophobicContact CB-CD2 4.4Å; L65-F103 HydrophobicContact CB-CE1 3.78Å; L65-F103 HydrophobicContact CB-CE2 4.26Å; L65-F103 HydrophobicContact CB-CG 4.25Å; L65-F103 HydrophobicContact CB-CZ 3.95Å; L65-F103 HydrophobicContact CD1-CB 3.9Å; L65-F103 HydrophobicContact CD1-CD1 4.04Å; L65-F103 HydrophobicContact CD1-CD2 4.37Å; L65-F103 HydrophobicContact CD1-CG 3.85Å; L65-F103 HydrophobicContact CG-CD1 4.44Å; L65-F108 HydrophobicContact CD2-CD1 4.15Å; L65-F108 HydrophobicContact CD2-CE1 4.25Å; L65-F108 HydrophobicContact CD2-CG 4.42Å; L65-I289 HydrophobicContact CD1-CG2 4.45Å; L65-I289 HydrophobicContact CD2-CG2 3.34Å; L65-I289 HydrophobicContact CG-CG2 3.54Å; L65-L293 HydrophobicContact CD1-CD1 4.02Å; L65-L293 HydrophobicContact CD1-CD2 4.12Å; L65-L293 HydrophobicContact CD1-CG 4.46Å; L65-L293 HydrophobicContact CD2-CD2 4Å
66	R	94.8	Very high	93.5	Very high	8 Å²	8	32.8 Å²	32.8	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-50.3	174.3	-71.4	176.2	-177.5	-80.3	0.9	111.1	E62 R63 L68 G69 C70 Q95 Y98 F103	E62-R66 WeakPolarHBondContact O-CG 3.41Å; E62-R66 PolarHBondContact O-N 3.29Å; E62-R66 IonicContact OE1-CZ 2.75Å; E62-R66 VanDerWaalsContact OE1-CZ 3.25Å; E62-R66 IonicContact OE1-NE 3.17Å; E62-R66 PolarHBondContact OE1-NE 3.48Å; E62-R66 IonicContact OE1-NH2 3.12Å; E62-R66 PolarHBondContact OE1-NH2 3.3Å; R63-R66 PolarHBondContact O-N 3.48Å; R66-L68 PolarHBondContact O-N 3.3Å; R66-G69 PolarHBondContact O-N 3.39Å; R66-C70 PolarHBondContact O-N 2.73Å; R66-C70 PolarHBondContact O-SG 2.93Å; R66-C70 VanDerWaalsContact O-SG 3.37Å; R66-Q95 PolarHBondContact NH1-O 3.46Å; R66-Q95 VanDerWaalsContact NH1-OE1 3.15Å; R66-Y98 PolarHBondContact NH2-O 3.49Å; R66-F103 HydrophobicContact CB-CZ 4.5Å; R66-F103 HydrophobicContact CG-CE2 3.68Å; R66-F103 HydrophobicContact CG-CZ 3.64Å
67	F	94.1	Very high	93.9	Very high	61 Å²	61	31.2 Å²	31.2	27%	0.268	15%	0.147	S	C	.	.	H	α-helix	trans	-57.8	-47.8	176.4	-176.4	-83.4	0	0	0	111.7	R63 N64 G69 C70 Q71 R223 M278	R63-F67 PolarHBondContact O-N 3.08Å; N64-F67 PolarHBondContact O-N 2.87Å; F67-G69 PolarHBondContact O-N 3.17Å; F67-C70 PolarHBondContact O-N 3.01Å; F67-Q71 WeakPolarHBondContact O-CB 3.44Å; F67-Q71 PolarHBondContact O-N 3.26Å; F67-R223 HydrophobicContact CD2-CB 3.72Å; F67-R223 HydrophobicContact CE2-CB 3.85Å; F67-R223 HydrophobicContact CE2-CG 4.35Å; F67-M278 HydrophobicContact CD2-CG 4.44Å; F67-M278 HydrophobicContact CD2-SD 4.28Å; F67-M278 HydrophobicContact CE2-CG 4.01Å; F67-M278 HydrophobicContact CE2-SD 3.84Å
68	L	93.1	Very high	94.1	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-46	179.5	177.8	57.8	0	0	0	111.7	N64 L65 R66 Q71 L72 F108 T286	N64-L68 VanDerWaalsContact O-CB 3.28Å; N64-L68 WeakPolarHBondContact O-CB 3.46Å; N64-L68 PolarHBondContact O-N 2.98Å; L65-L68 PolarHBondContact O-N 2.99Å; R66-L68 PolarHBondContact O-N 3.3Å; L68-Q71 WeakPolarHBondContact O-CB 3.32Å; L68-Q71 PolarHBondContact O-N 2.88Å; L68-Q71 VanDerWaalsContact O-N 3.17Å; L68-L72 HydrophobicContact CD1-CG 4.34Å; L68-L72 HydrophobicContact CG-CD1 4.42Å; L68-L72 WeakPolarHBondContact O-CG 3.24Å; L68-L72 PolarHBondContact O-N 3.27Å; L68-F108 HydrophobicContact CD2-CE2 3.94Å; L68-F108 HydrophobicContact CD2-CZ 4.09Å; L68-F108 HydrophobicContact CG-CE2 4.26Å; L68-T286 HydrophobicContact CD1-CG2 3.6Å; L68-T286 HydrophobicContact CD2-CG2 4.31Å
69	G	95.5	Very high	94.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.8	-46.3	177	0	0	0	0	0	113	L65 R66 F67 Q71 L72 I73 Y94	L65-G69 PolarHBondContact O-N 3.2Å; R66-G69 PolarHBondContact O-N 3.39Å; F67-G69 PolarHBondContact O-N 3.17Å; G69-Q71 VanDerWaalsContact C-N 3.26Å; G69-Q71 PolarHBondContact O-N 3.39Å; G69-L72 PolarHBondContact O-N 2.67Å; G69-I73 WeakPolarHBondContact O-CG1 3.33Å; G69-I73 PolarHBondContact O-N 2.95Å; G69-Y94 WeakPolarHBondContact CA-OH 3.45Å
70	C	96.3	Very high	94.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-37.4	174.3	-68.7	0	0	0	0	111.9	R66 F67 Q74 Q91 R223	R66-C70 PolarHBondContact O-N 2.73Å; R66-C70 PolarHBondContact O-SG 2.93Å; R66-C70 VanDerWaalsContact O-SG 3.37Å; F67-C70 PolarHBondContact O-N 3.01Å; C70-Q74 PolarHBondContact O-N 3.38Å; C70-Q91 HydrophobicContact CB-CB 4.48Å; C70-Q91 HydrophobicContact CB-CG 4.1Å; C70-Q91 PolarHBondContact O-NE2 2.95Å; C70-R223 HydrophobicContact CB-CB 4.4Å; C70-R223 HydrophobicContact CB-CG 4.21Å
71	Q	93.7	Very high	94.8	Very high	31 Å²	31	30.1 Å²	30.1	15%	0.145	13%	0.132	C	C	.	.	H	α-helix	trans	-66.8	-43.6	175.5	-180	174.6	-10.9	0	0	112.1	F67 L68 G69 I73 Q74 T75 Y416	F67-Q71 WeakPolarHBondContact O-CB 3.44Å; F67-Q71 PolarHBondContact O-N 3.26Å; L68-Q71 WeakPolarHBondContact O-CB 3.32Å; L68-Q71 PolarHBondContact O-N 2.88Å; L68-Q71 VanDerWaalsContact O-N 3.17Å; G69-Q71 VanDerWaalsContact C-N 3.26Å; G69-Q71 PolarHBondContact O-N 3.39Å; Q71-I73 VanDerWaalsContact C-N 3.33Å; Q71-I73 PolarHBondContact O-N 2.87Å; Q71-Q74 PolarHBondContact O-N 2.86Å; Q71-T75 PolarHBondContact O-N 3.22Å; Q71-T75 PolarHBondContact O-OG1 3.23Å; Q71-Y416 PolarHBondContact NE2-OH 3.39Å
72	L	94.8	Very high	95	Very high	14 Å²	14	30.5 Å²	30.5	7%	0.073	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-45.3	176	-69.7	174.5	0	0	0	111	L68 G69 Q74 T75 A76 F108 F136 M139	L68-L72 HydrophobicContact CD1-CG 4.34Å; L68-L72 HydrophobicContact CG-CD1 4.42Å; L68-L72 WeakPolarHBondContact O-CG 3.24Å; L68-L72 PolarHBondContact O-N 3.27Å; G69-L72 PolarHBondContact O-N 2.67Å; L72-Q74 PolarHBondContact O-N 3.15Å; L72-T75 PolarHBondContact O-N 2.84Å; L72-A76 VanDerWaalsContact O-CB 3.24Å; L72-A76 WeakPolarHBondContact O-CB 3.38Å; L72-A76 PolarHBondContact O-N 3.12Å; L72-F108 HydrophobicContact CD1-CD2 4.35Å; L72-F108 HydrophobicContact CD1-CE2 3.79Å; L72-F136 HydrophobicContact CB-CE1 4.18Å; L72-M139 HydrophobicContact CB-CE 4.22Å; L72-M139 HydrophobicContact CD2-CE 3.5Å; L72-M139 HydrophobicContact CG-CE 4.48Å
73	I	97.4	Very high	95.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-45.9	177.4	-68.4	168.5	0	0	0	111	G69 Q71 T75 A76 A77 Q91 Y94 A112 C115 I116	G69-I73 WeakPolarHBondContact O-CG1 3.33Å; G69-I73 PolarHBondContact O-N 2.95Å; Q71-I73 VanDerWaalsContact C-N 3.33Å; Q71-I73 PolarHBondContact O-N 2.87Å; I73-T75 PolarHBondContact O-N 2.98Å; I73-A76 PolarHBondContact O-N 3.03Å; I73-A77 VanDerWaalsContact O-CB 3.26Å; I73-A77 WeakPolarHBondContact O-CB 3.34Å; I73-A77 PolarHBondContact O-N 3.44Å; I73-Q91 HydrophobicContact CB-CG 4.09Å; I73-Q91 HydrophobicContact CG2-CG 3.82Å; I73-Y94 HydrophobicContact CD1-CD2 3.94Å; I73-Y94 HydrophobicContact CD1-CG 3.77Å; I73-A112 HydrophobicContact CD1-CB 4.43Å; I73-A112 HydrophobicContact CG1-CB 4.05Å; I73-C115 HydrophobicContact CD1-CB 4.09Å; I73-I116 HydrophobicContact CG2-CB 4.33Å; I73-I116 HydrophobicContact CG2-CD1 4.13Å
74	Q	95.9	Very high	95.2	Very high	13 Å²	13	28.1 Å²	28.1	6%	0.061	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-44.3	178.9	-178.1	64.1	49.6	0	0	112.3	C70 Q71 L72 A77 I78	C70-Q74 PolarHBondContact O-N 3.38Å; Q71-Q74 PolarHBondContact O-N 2.86Å; L72-Q74 PolarHBondContact O-N 3.15Å; Q74-A77 PolarHBondContact O-N 3.32Å; Q74-I78 HydrophobicContact CG-CD1 4.37Å; Q74-I78 WeakPolarHBondContact O-CD1 3.46Å; Q74-I78 WeakPolarHBondContact O-CG1 3.4Å; Q74-I78 PolarHBondContact O-N 3.4Å
75	T	95	Very high	95.3	Very high	18 Å²	18	29.6 Å²	29.6	11%	0.11	15%	0.145	C	C	.	.	H	α-helix	trans	-66.9	-43.5	178.8	-59.3	0	0	0	0	110.9	Q71 L72 I73 A77 I78 L79 M139	Q71-T75 PolarHBondContact O-N 3.22Å; Q71-T75 PolarHBondContact O-OG1 3.23Å; L72-T75 PolarHBondContact O-N 2.84Å; I73-T75 PolarHBondContact O-N 2.98Å; T75-A77 VanDerWaalsContact C-N 3.28Å; T75-A77 PolarHBondContact O-N 3.48Å; T75-I78 PolarHBondContact O-N 3.15Å; T75-L79 HydrophobicContact CG2-CD1 4.16Å; T75-L79 WeakPolarHBondContact O-CG 3.49Å; T75-L79 PolarHBondContact O-N 3.5Å; T75-L79 VanDerWaalsContact O-N 3.11Å; T75-M139 HydrophobicContact CG2-CE 3.85Å; T75-M139 HydrophobicContact CG2-CG 4.19Å; T75-M139 HydrophobicContact CG2-SD 4.08Å
76	A	96.8	Very high	95.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.6	-40	175.2	0	0	0	0	0	111.4	L72 I73 I78 L79 L80 V135 F136 M139	L72-A76 VanDerWaalsContact O-CB 3.24Å; L72-A76 WeakPolarHBondContact O-CB 3.38Å; L72-A76 PolarHBondContact O-N 3.12Å; I73-A76 PolarHBondContact O-N 3.03Å; A76-I78 PolarHBondContact O-N 3.34Å; A76-L79 PolarHBondContact O-N 3.06Å; A76-L80 VanDerWaalsContact O-CB 3.28Å; A76-L80 WeakPolarHBondContact O-CB 3.35Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.1Å; A76-V135 HydrophobicContact CB-CG1 3.94Å; A76-F136 HydrophobicContact CB-CD2 4.14Å; A76-F136 HydrophobicContact CB-CE2 3.5Å; A76-F136 VanDerWaalsContact CB-CE2 3.5Å; A76-F136 HydrophobicContact CB-CZ 4.07Å; A76-M139 HydrophobicContact CB-SD 3.94Å
77	A	97	Very high	95.5	Very high	2 Å²	2	29.2 Å²	29.2	2%	0.017	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-43.4	179	0	0	0	0	0	112.7	I73 Q74 T75 L80 R81 V82 A87 I116	I73-A77 VanDerWaalsContact O-CB 3.26Å; I73-A77 WeakPolarHBondContact O-CB 3.34Å; I73-A77 PolarHBondContact O-N 3.44Å; Q74-A77 PolarHBondContact O-N 3.32Å; T75-A77 VanDerWaalsContact C-N 3.28Å; T75-A77 PolarHBondContact O-N 3.48Å; A77-L80 PolarHBondContact O-N 2.87Å; A77-R81 PolarHBondContact O-N 3.13Å; A77-V82 VanDerWaalsContact CA-CG2 3.45Å; A77-V82 HydrophobicContact CB-CG2 3.47Å; A77-V82 VanDerWaalsContact CB-CG2 3.47Å; A77-V82 WeakPolarHBondContact O-CG2 3.38Å; A77-V82 PolarHBondContact O-N 3.29Å; A77-A87 HydrophobicContact CB-CB 3.45Å; A77-A87 VanDerWaalsContact CB-CB 3.45Å; A77-I116 HydrophobicContact CB-CD1 4.02Å
78	I	95.8	Very high	95.7	Very high	51 Å²	51	26.3 Å²	26.3	26%	0.262	13%	0.131	S	C	.	.	H	α-helix	trans	-62.5	-48	176.2	-66.1	159.2	0	0	0	110.2	Q74 T75 A76 L80 R81 I411	Q74-I78 HydrophobicContact CG-CD1 4.37Å; Q74-I78 WeakPolarHBondContact O-CD1 3.46Å; Q74-I78 WeakPolarHBondContact O-CG1 3.4Å; Q74-I78 PolarHBondContact O-N 3.4Å; T75-I78 PolarHBondContact O-N 3.15Å; A76-I78 PolarHBondContact O-N 3.34Å; I78-L80 PolarHBondContact O-N 3.21Å; I78-R81 PolarHBondContact O-N 2.94Å; I78-R81 VanDerWaalsContact O-N 3.08Å; I78-I411 HydrophobicContact CD1-CD1 4.18Å; I78-I411 HydrophobicContact CD1-CG2 4.09Å; I78-I411 HydrophobicContact CG2-CD1 4.02Å
79	L	95.2	Very high	95.8	Very high	42 Å²	42	25.8 Å²	25.8	22%	0.22	13%	0.128	C	C	.	.	H	α-helix	trans	-64.7	-37.3	-179.7	-70	172.9	0	0	0	112.8	T75 A76 R81 V135 M139 V408	T75-L79 HydrophobicContact CG2-CD1 4.16Å; T75-L79 WeakPolarHBondContact O-CG 3.49Å; T75-L79 PolarHBondContact O-N 3.5Å; T75-L79 VanDerWaalsContact O-N 3.11Å; A76-L79 PolarHBondContact O-N 3.06Å; L79-R81 VanDerWaalsContact C-N 3.25Å; L79-R81 PolarHBondContact O-N 3.06Å; L79-V135 HydrophobicContact CB-CB 4.49Å; L79-V135 HydrophobicContact CB-CG1 3.63Å; L79-V135 HydrophobicContact CB-CG2 4Å; L79-V135 HydrophobicContact CD1-CG1 3.76Å; L79-V135 HydrophobicContact CG-CG1 4.35Å; L79-M139 HydrophobicContact CD1-CG 3.54Å; L79-M139 HydrophobicContact CD1-SD 4Å; L79-V408 HydrophobicContact CD2-CG2 3.52Å; L79-V408 HydrophobicContact CG-CG2 4.46Å
80	L	96.3	Very high	95.9	Very high	15 Å²	15	25.8 Å²	25.8	8%	0.079	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-7.7	175.2	-70.1	169	0	0	0	113.3	A76 A77 I78 V82 I116 R127 D131 V132 V135	A76-L80 VanDerWaalsContact O-CB 3.28Å; A76-L80 WeakPolarHBondContact O-CB 3.35Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.46Å; A76-L80 PolarHBondContact O-N 3.1Å; A77-L80 PolarHBondContact O-N 2.87Å; I78-L80 PolarHBondContact O-N 3.21Å; L80-V82 HydrophobicContact CB-CG1 4.1Å; L80-V82 PolarHBondContact O-N 2.85Å; L80-I116 HydrophobicContact CD1-CG1 4.15Å; L80-R127 HydrophobicContact CB-CG 4.48Å; L80-R127 PolarHBondContact O-NE 3.02Å; L80-D131 HydrophobicContact CD2-CB 3.92Å; L80-V132 HydrophobicContact CD1-CG2 3.99Å; L80-V132 HydrophobicContact CD2-CG2 4.47Å; L80-V135 HydrophobicContact CD2-CB 4.22Å; L80-V135 HydrophobicContact CD2-CG2 3.63Å; L80-V135 HydrophobicContact CG-CB 4.28Å; L80-V135 HydrophobicContact CG-CG1 4.32Å; L80-V135 HydrophobicContact CG-CG2 3.91Å
81	R	95.5	Very high	96	Very high	162 Å²	162	25.8 Å²	25.8	61%	0.611	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	41.1	-174.9	-56.5	175.5	166.7	-157.4	-14.3	112.3	A77 I78 L79 R127 R404	A77-R81 PolarHBondContact O-N 3.13Å; I78-R81 PolarHBondContact O-N 2.94Å; I78-R81 VanDerWaalsContact O-N 3.08Å; L79-R81 VanDerWaalsContact C-N 3.25Å; L79-R81 PolarHBondContact O-N 3.06Å; R81-R127 PolarHBondContact O-NH2 2.94Å; R81-R404 VanDerWaalsContact NH2-NE 3.18Å; R81-R404 VanDerWaalsContact NH2-NH2 3.18Å
82	V	95.3	Very high	96.1	Very high	14 Å²	14	24.5 Å²	24.5	9%	0.085	12%	0.122	C	C	.	.			trans	-86.6	150.1	170.8	-62.5	0	0	0	0	109.2	A77 L80 A86 I116 R127	A77-V82 VanDerWaalsContact CA-CG2 3.45Å; A77-V82 HydrophobicContact CB-CG2 3.47Å; A77-V82 VanDerWaalsContact CB-CG2 3.47Å; A77-V82 WeakPolarHBondContact O-CG2 3.38Å; A77-V82 PolarHBondContact O-N 3.29Å; L80-V82 HydrophobicContact CB-CG1 4.1Å; L80-V82 PolarHBondContact O-N 2.85Å; V82-A86 HydrophobicContact CB-CB 4.28Å; V82-A86 HydrophobicContact CG2-CB 4.44Å; V82-I116 HydrophobicContact CG2-CD1 4.01Å; V82-R127 HydrophobicContact CG1-CG 3.55Å
83	P	95.8	Very high	96.2	Very high	54 Å²	54	23.8 Å²	23.8	35%	0.351	12%	0.119	S	C	.	.			trans	-61.8	153.7	179.6	26.4	-35.3	0	0	0	111.6	V85 A86 A87 T125	P83-V85 PolarHBondContact O-N 3.03Å; P83-V85 VanDerWaalsContact O-N 3.15Å; P83-A86 HydrophobicContact CG-CB 4.04Å; P83-A86 WeakPolarHBondContact O-CB 3.44Å; P83-A86 PolarHBondContact O-N 3.25Å; P83-A87 PolarHBondContact O-N 3.35Å; P83-A87 VanDerWaalsContact O-N 3.16Å; P83-T125 WeakPolarHBondContact CD-OG1 3.2Å; P83-T125 HydrophobicContact CG-CG2 4.01Å
84	Q	94.1	Very high	96.2	Very high	62 Å²	62	23.8 Å²	23.8	29%	0.29	12%	0.119	S	C	.	.	H	α-helix	trans	-59.6	-28.3	179.7	-176.9	57.5	31.9	0	0	112.8	A87 A88	Q84-A87 WeakPolarHBondContact O-CB 3.32Å; Q84-A87 PolarHBondContact O-N 3.25Å; Q84-A88 WeakPolarHBondContact O-CB 3.02Å; Q84-A88 PolarHBondContact O-N 2.95Å
85	V	95.5	Very high	96.2	Very high	64 Å²	64	23.4 Å²	23.4	39%	0.388	12%	0.117	S	C	.	.	H	α-helix	trans	-61.3	-45.7	174.9	-171.2	0	0	0	0	110.4	P83 A87 A88 A89 E123	P83-V85 PolarHBondContact O-N 3.03Å; P83-V85 VanDerWaalsContact O-N 3.15Å; V85-A87 PolarHBondContact O-N 3.17Å; V85-A88 PolarHBondContact O-N 3.49Å; V85-A89 WeakPolarHBondContact O-CB 3.29Å; V85-A89 PolarHBondContact O-N 3.44Å; V85-E123 HydrophobicContact CG1-CG 4.37Å; V85-E123 WeakPolarHBondContact CG1-OE2 3.36Å
86	A	96.5	Very high	96.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.9	-37	174.6	0	0	0	0	0	112.8	V82 P83 A89 G90 A119 E123	V82-A86 HydrophobicContact CB-CB 4.28Å; V82-A86 HydrophobicContact CG2-CB 4.44Å; P83-A86 HydrophobicContact CG-CB 4.04Å; P83-A86 WeakPolarHBondContact O-CB 3.44Å; P83-A86 PolarHBondContact O-N 3.25Å; A86-A89 PolarHBondContact O-N 3.26Å; A86-G90 PolarHBondContact O-N 2.99Å; A86-A119 VanDerWaalsContact O-CB 3.28Å; A86-A119 WeakPolarHBondContact O-CB 3.38Å; A86-E123 HydrophobicContact CB-CB 3.89Å; A86-E123 HydrophobicContact CB-CG 3.95Å
87	A	96.5	Very high	96.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.7	-47.7	174.2	0	0	0	0	0	111.5	A77 P83 Q84 V85 G90 Q91	A77-A87 HydrophobicContact CB-CB 3.45Å; A77-A87 VanDerWaalsContact CB-CB 3.45Å; P83-A87 PolarHBondContact O-N 3.35Å; P83-A87 VanDerWaalsContact O-N 3.16Å; Q84-A87 WeakPolarHBondContact O-CB 3.32Å; Q84-A87 PolarHBondContact O-N 3.25Å; V85-A87 PolarHBondContact O-N 3.17Å; A87-G90 PolarHBondContact O-N 3.5Å; A87-Q91 WeakPolarHBondContact O-CG 3.35Å; A87-Q91 PolarHBondContact O-N 3.13Å
88	A	96.6	Very high	96.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.3	-43.1	178.3	0	0	0	0	0	111.3	Q84 V85 G90 Q91 V92 H190 L222	Q84-A88 WeakPolarHBondContact O-CB 3.02Å; Q84-A88 PolarHBondContact O-N 2.95Å; V85-A88 PolarHBondContact O-N 3.49Å; A88-G90 VanDerWaalsContact C-N 3.35Å; A88-G90 PolarHBondContact O-N 3.01Å; A88-Q91 PolarHBondContact O-N 3.32Å; A88-V92 WeakPolarHBondContact O-CG2 3.16Å; A88-V92 PolarHBondContact O-N 2.97Å; A88-V92 VanDerWaalsContact O-N 3.07Å; A88-H190 VanDerWaalsContact C-CE1 3.5Å; A88-H190 WeakPolarHBondContact CB-CE1 3.4Å; A88-L222 HydrophobicContact CB-CD1 3.59Å; A88-L222 HydrophobicContact CB-CD2 3.9Å; A88-L222 HydrophobicContact CB-CG 4.44Å
89	A	96.8	Very high	96	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.9	-47.2	175.8	0	0	0	0	0	111.1	V85 A86 Q91 V92 L93 A119 E123 I188 H190	V85-A89 WeakPolarHBondContact O-CB 3.29Å; V85-A89 PolarHBondContact O-N 3.44Å; A86-A89 PolarHBondContact O-N 3.26Å; A89-Q91 VanDerWaalsContact C-N 3.33Å; A89-Q91 PolarHBondContact O-N 3.5Å; A89-V92 PolarHBondContact O-N 3.31Å; A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 3.43Å; A89-A119 HydrophobicContact CB-CB 4.14Å; A89-E123 HydrophobicContact CB-CG 4.43Å; A89-I188 HydrophobicContact CB-CD1 3.91Å; A89-I188 WeakPolarHBondContact O-CD1 3.42Å; A89-H190 PolarHBondContact N-CE1 2.67Å
90	G	97.7	Very high	95.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-41.5	176.7	0	0	0	0	0	113.4	A86 A87 A88 L93 Y94	A86-G90 PolarHBondContact O-N 2.99Å; A87-G90 PolarHBondContact O-N 3.5Å; A88-G90 VanDerWaalsContact C-N 3.35Å; A88-G90 PolarHBondContact O-N 3.01Å; G90-L93 PolarHBondContact O-N 3.01Å; G90-Y94 WeakPolarHBondContact O-CB 3.43Å; G90-Y94 PolarHBondContact O-N 3.06Å
91	Q	97.6	Very high	95.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.3	-41.6	177.6	-69.8	174.3	-47.5	0	0	112.2	C70 I73 A87 A88 A89 Y94 Q95	C70-Q91 HydrophobicContact CB-CB 4.48Å; C70-Q91 HydrophobicContact CB-CG 4.1Å; C70-Q91 PolarHBondContact O-NE2 2.95Å; I73-Q91 HydrophobicContact CB-CG 4.09Å; I73-Q91 HydrophobicContact CG2-CG 3.82Å; A87-Q91 WeakPolarHBondContact O-CG 3.35Å; A87-Q91 PolarHBondContact O-N 3.13Å; A88-Q91 PolarHBondContact O-N 3.32Å; A89-Q91 VanDerWaalsContact C-N 3.33Å; A89-Q91 PolarHBondContact O-N 3.5Å; Q91-Y94 WeakPolarHBondContact O-CB 3.48Å; Q91-Y94 PolarHBondContact O-N 2.84Å; Q91-Q95 WeakPolarHBondContact O-CG 3.28Å; Q91-Q95 PolarHBondContact O-N 3.15Å
92	V	96.7	Very high	95.7	Very high	3 Å²	3	17 Å²	17	2%	0.018	9%	0.093	C	C	.	.	H	α-helix	trans	-67.5	-43.4	177.7	172.6	0	0	0	0	110.8	A88 A89 Y94 Q95 R96 I188 L222 F227 M228	A88-V92 WeakPolarHBondContact O-CG2 3.16Å; A88-V92 PolarHBondContact O-N 2.97Å; A88-V92 VanDerWaalsContact O-N 3.07Å; A89-V92 PolarHBondContact O-N 3.31Å; V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 3.21Å; V92-Q95 PolarHBondContact O-N 3.33Å; V92-R96 HydrophobicContact CG1-CG 4.47Å; V92-R96 WeakPolarHBondContact O-CG 3.48Å; V92-R96 PolarHBondContact O-N 2.97Å; V92-I188 HydrophobicContact CB-CD1 3.85Å; V92-I188 HydrophobicContact CB-CG1 4.41Å; V92-I188 HydrophobicContact CB-CG2 4.3Å; V92-I188 HydrophobicContact CG1-CD1 3.84Å; V92-I188 HydrophobicContact CG1-CG1 3.93Å; V92-I188 HydrophobicContact CG1-CG2 4.06Å; V92-I188 HydrophobicContact CG2-CG2 4.26Å; V92-L222 HydrophobicContact CG2-CD2 3.98Å; V92-F227 HydrophobicContact CG2-CB 4.22Å; V92-F227 HydrophobicContact CG2-CD1 3.78Å; V92-F227 HydrophobicContact CG2-CE1 4.28Å; V92-F227 HydrophobicContact CG2-CG 3.95Å; V92-M228 HydrophobicContact CG1-CE 3.93Å
93	L	97.1	Very high	95.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.4	-43.4	175	-68.4	174.5	0	0	0	111.7	A89 G90 R96 F97 L118 A119 I122 L182 V186 I188	A89-L93 WeakPolarHBondContact O-CG 3.35Å; A89-L93 PolarHBondContact O-N 3.43Å; G90-L93 PolarHBondContact O-N 3.01Å; L93-R96 PolarHBondContact O-N 3.06Å; L93-F97 WeakPolarHBondContact O-CB 3.49Å; L93-F97 PolarHBondContact O-N 3.14Å; L93-L118 HydrophobicContact CD1-CD2 4.12Å; L93-L118 HydrophobicContact CD1-CG 4.25Å; L93-A119 HydrophobicContact CD1-CB 4.4Å; L93-I122 HydrophobicContact CD1-CD1 3.8Å; L93-L182 HydrophobicContact CD2-CD1 3.63Å; L93-V186 HydrophobicContact CD2-CB 4.07Å; L93-V186 HydrophobicContact CD2-CG1 4.13Å; L93-I188 HydrophobicContact CD2-CD1 4.02Å; L93-I188 HydrophobicContact CG-CD1 3.89Å
94	Y	97.5	Very high	95.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-46.1	177.7	-179.5	-93.7	0	0	0	112.2	G69 I73 G90 Q91 V92 F97 Y98 F103 T111 A112	G69-Y94 WeakPolarHBondContact CA-OH 3.45Å; I73-Y94 HydrophobicContact CD1-CD2 3.94Å; I73-Y94 HydrophobicContact CD1-CG 3.77Å; G90-Y94 WeakPolarHBondContact O-CB 3.43Å; G90-Y94 PolarHBondContact O-N 3.06Å; Q91-Y94 WeakPolarHBondContact O-CB 3.48Å; Q91-Y94 PolarHBondContact O-N 2.84Å; V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 3.21Å; Y94-F97 PolarHBondContact O-N 3.41Å; Y94-Y98 HydrophobicContact CD1-CD2 4.21Å; Y94-Y98 HydrophobicContact CD2-CD2 4.14Å; Y94-Y98 AromaticContact CD2-CE2 3.91Å; Y94-Y98 HydrophobicContact CD2-CE2 3.91Å; Y94-Y98 AromaticContact CE1-CD2 3.86Å; Y94-Y98 HydrophobicContact CE1-CD2 3.86Å; Y94-Y98 HydrophobicContact CE1-CE2 4.18Å; Y94-Y98 AromaticContact CE2-CD2 3.83Å; Y94-Y98 HydrophobicContact CE2-CD2 3.83Å; Y94-Y98 AromaticContact CE2-CE2 3.34Å; Y94-Y98 HydrophobicContact CE2-CE2 3.34Å; Y94-Y98 HydrophobicContact CG-CD2 4.33Å; Y94-Y98 AromaticContact CZ-CD2 3.66Å; Y94-Y98 AromaticContact CZ-CE2 3.48Å; Y94-Y98 VanDerWaalsContact CZ-CE2 3.48Å; Y94-Y98 WeakPolarHBondContact O-CD2 3.44Å; Y94-Y98 PolarHBondContact O-N 3.3Å; Y94-Y98 VanDerWaalsContact O-N 3.17Å; Y94-F103 HydrophobicContact CE1-CE1 4.45Å; Y94-F103 HydrophobicContact CE1-CZ 4.38Å; Y94-F103 WeakPolarHBondContact OH-CE1 3.43Å; Y94-T111 HydrophobicContact CD2-CG2 4Å; Y94-T111 HydrophobicContact CE2-CG2 4.22Å; Y94-A112 HydrophobicContact CD2-CB 4.32Å; Y94-A112 HydrophobicContact CE2-CB 4Å
95	Q	95.9	Very high	95.3	Very high	4 Å²	4	18 Å²	18	2%	0.019	9%	0.086	C	C	.	.	H	α-helix	trans	-62.2	-48	176.7	-70.6	-75.6	20.8	0	0	111.5	R66 Q91 V92 F97 Y98 Y99 T224 M228	R66-Q95 PolarHBondContact NH1-O 3.46Å; R66-Q95 VanDerWaalsContact NH1-OE1 3.15Å; Q91-Q95 WeakPolarHBondContact O-CG 3.28Å; Q91-Q95 PolarHBondContact O-N 3.15Å; V92-Q95 PolarHBondContact O-N 3.33Å; Q95-F97 VanDerWaalsContact C-N 3.3Å; Q95-F97 PolarHBondContact O-N 2.66Å; Q95-Y98 PolarHBondContact O-N 3.2Å; Q95-Y99 VanDerWaalsContact O-CD2 3.22Å; Q95-Y99 WeakPolarHBondContact O-CD2 3.19Å; Q95-Y99 PolarHBondContact O-N 3.37Å; Q95-T224 PolarHBondContact NE2-O 2.88Å; Q95-M228 HydrophobicContact CB-CG 4.41Å; Q95-M228 HydrophobicContact CB-SD 4.16Å
96	R	94.9	Very high	95.2	Very high	16 Å²	16	15.4 Å²	15.4	6%	0.06	7%	0.071	C	C	.	.	H	α-helix	trans	-56	-46.2	177.6	-72	-178	174.6	168.3	5	111	V92 L93 Y98 Y99 S100 L182 C185 H187 M228	V92-R96 HydrophobicContact CG1-CG 4.47Å; V92-R96 WeakPolarHBondContact O-CG 3.48Å; V92-R96 PolarHBondContact O-N 2.97Å; L93-R96 PolarHBondContact O-N 3.06Å; R96-Y98 PolarHBondContact O-N 3.1Å; R96-Y99 PolarHBondContact O-N 3.04Å; R96-S100 PolarHBondContact O-N 3.15Å; R96-L182 HydrophobicContact CB-CD1 4.49Å; R96-L182 HydrophobicContact CB-CD2 3.51Å; R96-C185 PolarHBondContact NH1-O 2.89Å; R96-H187 PolarHBondContact NH1-O 3.08Å; R96-H187 VanDerWaalsContact NH1-O 3.11Å; R96-M228 HydrophobicContact CB-SD 4.19Å; R96-M228 HydrophobicContact CG-CE 3.57Å; R96-M228 HydrophobicContact CG-SD 3.43Å; R96-M228 WeakPolarHBondContact CG-SD 3.49Å
97	F	95.8	Very high	95	Very high	3 Å²	3	16.8 Å²	16.8	1%	0.013	8%	0.078	C	C	.	.	H	α-helix	trans	-58.2	-47.8	179.2	178.7	-97.8	0	0	0	112.2	L93 Y94 Q95 Y99 S100 K101 C106 T111 R177 V178 E181	L93-F97 WeakPolarHBondContact O-CB 3.49Å; L93-F97 PolarHBondContact O-N 3.14Å; Y94-F97 PolarHBondContact O-N 3.41Å; Q95-F97 VanDerWaalsContact C-N 3.3Å; Q95-F97 PolarHBondContact O-N 2.66Å; F97-Y99 VanDerWaalsContact C-N 3.28Å; F97-Y99 PolarHBondContact O-N 3.4Å; F97-S100 CarbonylContact O-C 3.42Å; F97-S100 WeakPolarHBondContact O-CA 3.21Å; F97-S100 PolarHBondContact O-N 2.89Å; F97-K101 HydrophobicContact CD1-CB 4.46Å; F97-K101 HydrophobicContact CE1-CB 3.96Å; F97-K101 HydrophobicContact CE1-CG 4.38Å; F97-K101 HydrophobicContact CE2-CB 4.4Å; F97-K101 HydrophobicContact CE2-CG 3.95Å; F97-K101 HydrophobicContact CZ-CB 3.94Å; F97-K101 HydrophobicContact CZ-CG 3.86Å; F97-K101 PolarHBondContact O-N 3.1Å; F97-C106 HydrophobicContact CE1-CB 3.96Å; F97-C106 HydrophobicContact CZ-CB 4.19Å; F97-T111 HydrophobicContact CD1-CG2 3.52Å; F97-T111 HydrophobicContact CE1-CG2 3.79Å; F97-T111 HydrophobicContact CG-CG2 4.14Å; F97-R177 HydrophobicContact CE2-CB 4.37Å; F97-V178 HydrophobicContact CB-CG2 4.49Å; F97-V178 HydrophobicContact CD2-CB 4.3Å; F97-V178 HydrophobicContact CD2-CG2 3.78Å; F97-V178 HydrophobicContact CE2-CG2 4.13Å; F97-V178 HydrophobicContact CG-CG2 4.08Å; F97-E181 HydrophobicContact CD2-CB 4.17Å; F97-E181 HydrophobicContact CD2-CG 4.42Å; F97-E181 HydrophobicContact CE2-CB 4.24Å; F97-E181 HydrophobicContact CE2-CG 4Å
98	Y	95.5	Very high	94.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-76.6	-10.2	-178.8	-79.6	-65.9	0	0	0	114.5	R66 Y94 Q95 R96 S100 K101 F103 C106 F108 T111	R66-Y98 PolarHBondContact NH2-O 3.49Å; Y94-Y98 HydrophobicContact CD1-CD2 4.21Å; Y94-Y98 HydrophobicContact CD2-CD2 4.14Å; Y94-Y98 AromaticContact CD2-CE2 3.91Å; Y94-Y98 HydrophobicContact CD2-CE2 3.91Å; Y94-Y98 AromaticContact CE1-CD2 3.86Å; Y94-Y98 HydrophobicContact CE1-CD2 3.86Å; Y94-Y98 HydrophobicContact CE1-CE2 4.18Å; Y94-Y98 AromaticContact CE2-CD2 3.83Å; Y94-Y98 HydrophobicContact CE2-CD2 3.83Å; Y94-Y98 AromaticContact CE2-CE2 3.34Å; Y94-Y98 HydrophobicContact CE2-CE2 3.34Å; Y94-Y98 HydrophobicContact CG-CD2 4.33Å; Y94-Y98 AromaticContact CZ-CD2 3.66Å; Y94-Y98 AromaticContact CZ-CE2 3.48Å; Y94-Y98 VanDerWaalsContact CZ-CE2 3.48Å; Y94-Y98 WeakPolarHBondContact O-CD2 3.44Å; Y94-Y98 PolarHBondContact O-N 3.3Å; Y94-Y98 VanDerWaalsContact O-N 3.17Å; Q95-Y98 PolarHBondContact O-N 3.2Å; R96-Y98 PolarHBondContact O-N 3.1Å; Y98-S100 VanDerWaalsContact C-N 3.3Å; Y98-K101 CarbonylContact C-O 3.48Å; Y98-K101 WeakPolarHBondContact CA-O 3.23Å; Y98-F103 HydrophobicContact CD1-CB 4.45Å; Y98-F103 AromaticContact CD1-CD1 3.59Å; Y98-F103 HydrophobicContact CD1-CD1 3.59Å; Y98-F103 AromaticContact CD1-CD2 3.64Å; Y98-F103 HydrophobicContact CD1-CD2 3.64Å; Y98-F103 AromaticContact CD1-CE1 3.57Å; Y98-F103 HydrophobicContact CD1-CE1 3.57Å; Y98-F103 AromaticContact CD1-CE2 3.64Å; Y98-F103 HydrophobicContact CD1-CE2 3.64Å; Y98-F103 AromaticContact CD1-CG 3.63Å; Y98-F103 HydrophobicContact CD1-CG 3.63Å; Y98-F103 AromaticContact CD1-CZ 3.6Å; Y98-F103 HydrophobicContact CD1-CZ 3.6Å; Y98-F103 HydrophobicContact CD2-CD1 4.29Å; Y98-F103 AromaticContact CD2-CE1 3.5Å; Y98-F103 HydrophobicContact CD2-CE1 3.5Å; Y98-F103 HydrophobicContact CD2-CE2 4.27Å; Y98-F103 AromaticContact CD2-CZ 3.49Å; Y98-F103 HydrophobicContact CD2-CZ 3.49Å; Y98-F103 VanDerWaalsContact CD2-CZ 3.49Å; Y98-F103 HydrophobicContact CE1-CB 4.28Å; Y98-F103 AromaticContact CE1-CD1 3.39Å; Y98-F103 HydrophobicContact CE1-CD1 3.39Å; Y98-F103 HydrophobicContact CE1-CD2 4.22Å; Y98-F103 AromaticContact CE1-CE1 3.64Å; Y98-F103 HydrophobicContact CE1-CE1 3.64Å; Y98-F103 HydrophobicContact CE1-CE2 4.44Å; Y98-F103 AromaticContact CE1-CG 3.72Å; Y98-F103 HydrophobicContact CE1-CG 3.72Å; Y98-F103 HydrophobicContact CE1-CZ 4.17Å; Y98-F103 HydrophobicContact CE2-CD1 4.1Å; Y98-F103 AromaticContact CE2-CE1 3.55Å; Y98-F103 HydrophobicContact CE2-CE1 3.55Å; Y98-F103 HydrophobicContact CE2-CZ 4.06Å; Y98-F103 HydrophobicContact CG-CD1 4.06Å; Y98-F103 HydrophobicContact CG-CD2 4.07Å; Y98-F103 AromaticContact CG-CE1 3.52Å; Y98-F103 HydrophobicContact CG-CE1 3.52Å; Y98-F103 AromaticContact CG-CE2 3.55Å; Y98-F103 HydrophobicContact CG-CE2 3.55Å; Y98-F103 HydrophobicContact CG-CG 4.31Å; Y98-F103 AromaticContact CG-CZ 3.24Å; Y98-F103 HydrophobicContact CG-CZ 3.24Å; Y98-F103 AromaticContact CZ-CD1 3.66Å; Y98-F103 AromaticContact CZ-CE1 3.62Å; Y98-C106 HydrophobicContact CE1-CB 4.3Å; Y98-C106 PolarHBondContact OH-O 3.17Å; Y98-F108 HydrophobicContact CE2-CB 4.45Å; Y98-F108 WeakPolarHBondContact OH-CA 3.49Å; Y98-F108 PolarHBondContact OH-N 3.08Å; Y98-T111 HydrophobicContact CE2-CG2 3.66Å; Y98-T111 WeakPolarHBondContact OH-CB 2.98Å; Y98-T111 PolarHBondContact OH-OG1 3.43Å
99	Y	94	Very high	94.8	Very high	18 Å²	18	19 Å²	19	7%	0.071	9%	0.088	C	C	.	.	H	α-helix	trans	-80.4	-12.9	163.9	-82.7	-69.5	0	0	0	113.1	L42 L47 P50 P51 Q95 R96 F97 D225 M228	L42-Y99 HydrophobicContact CD1-CD1 4.06Å; L42-Y99 HydrophobicContact CD1-CD2 3.98Å; L42-Y99 HydrophobicContact CD1-CG 3.53Å; L47-Y99 HydrophobicContact CD2-CD1 4.13Å; L47-Y99 HydrophobicContact CD2-CE1 3.66Å; L47-Y99 HydrophobicContact CD2-CE2 4.31Å; P50-Y99 HydrophobicContact CB-CD1 4.41Å; P50-Y99 HydrophobicContact CB-CE1 4.46Å; P51-Y99 WeakPolarHBondContact CD-O 3.34Å; Q95-Y99 VanDerWaalsContact O-CD2 3.22Å; Q95-Y99 WeakPolarHBondContact O-CD2 3.19Å; Q95-Y99 PolarHBondContact O-N 3.37Å; R96-Y99 PolarHBondContact O-N 3.04Å; F97-Y99 VanDerWaalsContact C-N 3.28Å; F97-Y99 PolarHBondContact O-N 3.4Å; Y99-D225 HydrophobicContact CE2-CB 4.05Å; Y99-D225 WeakPolarHBondContact OH-CB 3.47Å; Y99-D225 PolarHBondContact OH-OD2 2.95Å; Y99-M228 HydrophobicContact CD2-CB 4.33Å; Y99-M228 HydrophobicContact CD2-CG 3.62Å; Y99-M228 HydrophobicContact CD2-SD 4.1Å; Y99-M228 HydrophobicContact CE2-CB 4.21Å; Y99-M228 HydrophobicContact CE2-CG 3.58Å
100	S	92.1	Very high	94.8	Very high	49 Å²	49	20.4 Å²	20.4	34%	0.343	10%	0.095	S	C	.	.	H	α-helix	trans	-103.6	-26.1	173.6	-59.6	0	0	0	0	113.3	R96 F97 Y98	R96-S100 PolarHBondContact O-N 3.15Å; F97-S100 CarbonylContact O-C 3.42Å; F97-S100 WeakPolarHBondContact O-CA 3.21Å; F97-S100 PolarHBondContact O-N 2.89Å; Y98-S100 VanDerWaalsContact C-N 3.3Å
101	K	94.1	Very high	94.8	Very high	67 Å²	67	20.6 Å²	20.6	29%	0.291	10%	0.096	S	C	.	.	S	Bend	trans	-128.9	156.5	-178.1	-65.8	-61.8	179.2	-171.1	0	113	F97 Y98 E181	F97-K101 HydrophobicContact CD1-CB 4.46Å; F97-K101 HydrophobicContact CE1-CB 3.96Å; F97-K101 HydrophobicContact CE1-CG 4.38Å; F97-K101 HydrophobicContact CE2-CB 4.4Å; F97-K101 HydrophobicContact CE2-CG 3.95Å; F97-K101 HydrophobicContact CZ-CB 3.94Å; F97-K101 HydrophobicContact CZ-CG 3.86Å; F97-K101 PolarHBondContact O-N 3.1Å; Y98-K101 CarbonylContact C-O 3.48Å; Y98-K101 WeakPolarHBondContact CA-O 3.23Å; K101-E181 VanDerWaalsContact CE-CG 3.43Å; K101-E181 WeakPolarHBondContact CE-OE1 3.36Å; K101-E181 WeakPolarHBondContact CE-OE2 3.42Å; K101-E181 HydrophobicContact CG-CG 4.18Å; K101-E181 IonicContact NZ-OE1 3.94Å; K101-E181 PolarHBondContact NZ-OE1 3.22Å; K101-E181 IonicContact NZ-OE2 3.98Å; K101-E181 PolarHBondContact NZ-OE2 3Å; K101-E181 VanDerWaalsContact NZ-OE2 3.14Å
102	S	94.3	Very high	94.8	Very high	4 Å²	4	20.6 Å²	20.6	3%	0.028	10%	0.096	C	C	.	.			trans	-83.4	139.7	179.6	170.4	0	0	0	0	112.4	S52 D55 V104 R105 C106	S52-S102 WeakPolarHBondContact CA-OG 3.18Å; S52-S102 WeakPolarHBondContact OG-CA 3.39Å; D55-S102 WeakPolarHBondContact OD2-CB 3.32Å; D55-S102 PolarHBondContact OD2-OG 3.15Å; S102-V104 PolarHBondContact O-N 2.91Å; S102-V104 WeakPolarHBondContact OG-CB 3.06Å; S102-V104 PolarHBondContact OG-N 3.32Å; S102-R105 PolarHBondContact O-N 3.49Å; S102-C106 PolarHBondContact O-N 3Å; S102-C106 VanDerWaalsContact O-N 3.16Å
103	F	94.7	Very high	94.9	Very high	3 Å²	3	20.5 Å²	20.5	1%	0.013	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.2	168.5	-78.9	-78.8	0	0	0	113.2	S52 L57 E62 L65 R66 Y94 Y98 R105 F108 L293	S52-F103 WeakPolarHBondContact OG-CD2 3.29Å; S52-F103 PolarHBondContact OG-N 3.27Å; L57-F103 HydrophobicContact CD2-CB 4.07Å; E62-F103 HydrophobicContact CG-CD2 3.64Å; E62-F103 HydrophobicContact CG-CE2 3.72Å; L65-F103 HydrophobicContact CB-CD1 3.94Å; L65-F103 HydrophobicContact CB-CD2 4.4Å; L65-F103 HydrophobicContact CB-CE1 3.78Å; L65-F103 HydrophobicContact CB-CE2 4.26Å; L65-F103 HydrophobicContact CB-CG 4.25Å; L65-F103 HydrophobicContact CB-CZ 3.95Å; L65-F103 HydrophobicContact CD1-CB 3.9Å; L65-F103 HydrophobicContact CD1-CD1 4.04Å; L65-F103 HydrophobicContact CD1-CD2 4.37Å; L65-F103 HydrophobicContact CD1-CG 3.85Å; L65-F103 HydrophobicContact CG-CD1 4.44Å; R66-F103 HydrophobicContact CB-CZ 4.5Å; R66-F103 HydrophobicContact CG-CE2 3.68Å; R66-F103 HydrophobicContact CG-CZ 3.64Å; Y94-F103 HydrophobicContact CE1-CE1 4.45Å; Y94-F103 HydrophobicContact CE1-CZ 4.38Å; Y94-F103 WeakPolarHBondContact OH-CE1 3.43Å; Y98-F103 HydrophobicContact CD1-CB 4.45Å; Y98-F103 AromaticContact CD1-CD1 3.59Å; Y98-F103 HydrophobicContact CD1-CD1 3.59Å; Y98-F103 AromaticContact CD1-CD2 3.64Å; Y98-F103 HydrophobicContact CD1-CD2 3.64Å; Y98-F103 AromaticContact CD1-CE1 3.57Å; Y98-F103 HydrophobicContact CD1-CE1 3.57Å; Y98-F103 AromaticContact CD1-CE2 3.64Å; Y98-F103 HydrophobicContact CD1-CE2 3.64Å; Y98-F103 AromaticContact CD1-CG 3.63Å; Y98-F103 HydrophobicContact CD1-CG 3.63Å; Y98-F103 AromaticContact CD1-CZ 3.6Å; Y98-F103 HydrophobicContact CD1-CZ 3.6Å; Y98-F103 HydrophobicContact CD2-CD1 4.29Å; Y98-F103 AromaticContact CD2-CE1 3.5Å; Y98-F103 HydrophobicContact CD2-CE1 3.5Å; Y98-F103 HydrophobicContact CD2-CE2 4.27Å; Y98-F103 AromaticContact CD2-CZ 3.49Å; Y98-F103 HydrophobicContact CD2-CZ 3.49Å; Y98-F103 VanDerWaalsContact CD2-CZ 3.49Å; Y98-F103 HydrophobicContact CE1-CB 4.28Å; Y98-F103 AromaticContact CE1-CD1 3.39Å; Y98-F103 HydrophobicContact CE1-CD1 3.39Å; Y98-F103 HydrophobicContact CE1-CD2 4.22Å; Y98-F103 AromaticContact CE1-CE1 3.64Å; Y98-F103 HydrophobicContact CE1-CE1 3.64Å; Y98-F103 HydrophobicContact CE1-CE2 4.44Å; Y98-F103 AromaticContact CE1-CG 3.72Å; Y98-F103 HydrophobicContact CE1-CG 3.72Å; Y98-F103 HydrophobicContact CE1-CZ 4.17Å; Y98-F103 HydrophobicContact CE2-CD1 4.1Å; Y98-F103 AromaticContact CE2-CE1 3.55Å; Y98-F103 HydrophobicContact CE2-CE1 3.55Å; Y98-F103 HydrophobicContact CE2-CZ 4.06Å; Y98-F103 HydrophobicContact CG-CD1 4.06Å; Y98-F103 HydrophobicContact CG-CD2 4.07Å; Y98-F103 AromaticContact CG-CE1 3.52Å; Y98-F103 HydrophobicContact CG-CE1 3.52Å; Y98-F103 AromaticContact CG-CE2 3.55Å; Y98-F103 HydrophobicContact CG-CE2 3.55Å; Y98-F103 HydrophobicContact CG-CG 4.31Å; Y98-F103 AromaticContact CG-CZ 3.24Å; Y98-F103 HydrophobicContact CG-CZ 3.24Å; Y98-F103 AromaticContact CZ-CD1 3.66Å; Y98-F103 AromaticContact CZ-CE1 3.62Å; F103-R105 VanDerWaalsContact C-N 3.34Å; F103-F108 HydrophobicContact CD1-CB 3.86Å; F103-F108 HydrophobicContact CE1-CB 3.98Å; F103-L293 HydrophobicContact CB-CD1 3.98Å
104	V	92.4	Very high	94.9	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.024	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-33.6	-177	-175.7	0	0	0	0	111.2	D55 L57 S102 L293 R296 S297 C300	D55-V104 HydrophobicContact CB-CB 3.96Å; D55-V104 HydrophobicContact CB-CG1 4.3Å; D55-V104 HydrophobicContact CB-CG2 3.83Å; L57-V104 HydrophobicContact CB-CG2 4.12Å; S102-V104 PolarHBondContact O-N 2.91Å; S102-V104 WeakPolarHBondContact OG-CB 3.06Å; S102-V104 PolarHBondContact OG-N 3.32Å; V104-L293 HydrophobicContact CG2-CD1 4.29Å; V104-R296 HydrophobicContact CG1-CG 4.29Å; V104-R296 HydrophobicContact CG2-CG 4.04Å; V104-S297 PolarHBondContact O-OG 3.28Å; V104-C300 HydrophobicContact CG1-CB 3.62Å
105	R	90.1	Very high	95	Very high	142 Å²	142	20.5 Å²	20.5	54%	0.536	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-20.8	-176.9	-57.4	-178.1	-167.9	-160.7	-0.1	113.9	D55 S102 F103	D55-R105 IonicContact OD1-CZ 3.75Å; D55-R105 IonicContact OD1-NE 2.73Å; D55-R105 PolarHBondContact OD1-NE 3.06Å; D55-R105 IonicContact OD1-NH2 3.34Å; D55-R105 PolarHBondContact OD1-NH2 3.44Å; D55-R105 WeakPolarHBondContact OD2-CG 3.36Å; D55-R105 IonicContact OD2-CZ 3.15Å; D55-R105 IonicContact OD2-NE 3.89Å; D55-R105 PolarHBondContact OD2-NE 3.12Å; D55-R105 IonicContact OD2-NH2 3.36Å; S102-R105 PolarHBondContact O-N 3.49Å; F103-R105 VanDerWaalsContact C-N 3.34Å
106	C	91.9	Very high	95.1	Very high	11 Å²	11	20.4 Å²	20.4	7%	0.074	10%	0.095	C	C	.	.	S	Bend	trans	-126.1	116.7	-176.1	-64.8	0	0	0	0	110.6	F97 Y98 S102 F108	F97-C106 HydrophobicContact CE1-CB 3.96Å; F97-C106 HydrophobicContact CZ-CB 4.19Å; Y98-C106 HydrophobicContact CE1-CB 4.3Å; Y98-C106 PolarHBondContact OH-O 3.17Å; S102-C106 PolarHBondContact O-N 3Å; S102-C106 VanDerWaalsContact O-N 3.16Å; C106-F108 PolarHBondContact O-N 3.3Å; C106-F108 VanDerWaalsContact O-N 3.11Å
107	N	93.4	Very high	95.2	Very high	28 Å²	28	21.7 Å²	21.7	15%	0.15	10%	0.1	C	C	.	.			trans	-58.5	115.4	179.8	-176.7	-28.6	0	0	0	111.8	E109 H110 T111 Y323	N107-E109 VanDerWaalsContact C-N 3.32Å; N107-E109 PolarHBondContact O-N 2.89Å; N107-E109 WeakPolarHBondContact OD1-CB 3.23Å; N107-E109 PolarHBondContact OD1-N 3.23Å; N107-H110 HydrophobicContact CB-CB 4.29Å; N107-H110 PolarHBondContact O-N 3.27Å; N107-H110 PolarHBondContact OD1-N 3.49Å; N107-T111 PolarHBondContact O-N 2.8Å; N107-T111 PolarHBondContact O-OG1 2.9Å; N107-Y323 PolarHBondContact ND2-OH 3.42Å; N107-Y323 VanDerWaalsContact ND2-OH 3.13Å
108	F	94.6	Very high	95.3	Very high	7 Å²	7	22 Å²	22	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-66.7	-27.4	-175.1	83.2	-88.9	0	0	0	115.1	L65 L68 L72 Y98 F103 C106 A112 L293	L65-F108 HydrophobicContact CD2-CD1 4.15Å; L65-F108 HydrophobicContact CD2-CE1 4.25Å; L65-F108 HydrophobicContact CD2-CG 4.42Å; L68-F108 HydrophobicContact CD2-CE2 3.94Å; L68-F108 HydrophobicContact CD2-CZ 4.09Å; L68-F108 HydrophobicContact CG-CE2 4.26Å; L72-F108 HydrophobicContact CD1-CD2 4.35Å; L72-F108 HydrophobicContact CD1-CE2 3.79Å; Y98-F108 HydrophobicContact CE2-CB 4.45Å; Y98-F108 WeakPolarHBondContact OH-CA 3.49Å; Y98-F108 PolarHBondContact OH-N 3.08Å; F103-F108 HydrophobicContact CD1-CB 3.86Å; F103-F108 HydrophobicContact CE1-CB 3.98Å; C106-F108 PolarHBondContact O-N 3.3Å; C106-F108 VanDerWaalsContact O-N 3.11Å; F108-A112 VanDerWaalsContact O-CB 3.24Å; F108-A112 WeakPolarHBondContact O-CB 3.21Å; F108-A112 PolarHBondContact O-N 3.32Å; F108-L293 HydrophobicContact CD1-CD2 3.67Å; F108-L293 HydrophobicContact CE1-CD2 4.11Å
109	E	94.6	Very high	95.4	Very high	39 Å²	39	22 Å²	22	18%	0.182	10%	0.102	C	C	.	.	H	α-helix	trans	-72	-42.4	176.3	-61.9	-170.6	128.8	0	0	110.5	N107 A112 M113 K140	N107-E109 VanDerWaalsContact C-N 3.32Å; N107-E109 PolarHBondContact O-N 2.89Å; N107-E109 WeakPolarHBondContact OD1-CB 3.23Å; N107-E109 PolarHBondContact OD1-N 3.23Å; E109-A112 PolarHBondContact O-N 3.39Å; E109-M113 HydrophobicContact CB-CE 4.15Å; E109-M113 VanDerWaalsContact O-CE 3.28Å; E109-M113 WeakPolarHBondContact O-CE 3.36Å; E109-M113 WeakPolarHBondContact O-CG 3.39Å; E109-M113 PolarHBondContact O-N 2.88Å; E109-K140 VanDerWaalsContact CD-CE 3.46Å; E109-K140 WeakPolarHBondContact OE1-CE 3.44Å; E109-K140 IonicContact OE1-NZ 3.95Å; E109-K140 PolarHBondContact OE1-NZ 3.37Å; E109-K140 VanDerWaalsContact OE2-CE 3.26Å; E109-K140 WeakPolarHBondContact OE2-CE 3.34Å; E109-K140 IonicContact OE2-NZ 3.86Å; E109-K140 PolarHBondContact OE2-NZ 2.9Å
110	H	96.7	Very high	95.6	Very high	30 Å²	30	21.2 Å²	21.2	14%	0.139	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-44.2	175.8	-62.4	174	0	0	0	110.6	N107 A112 M113 A114 L167 A174	N107-H110 HydrophobicContact CB-CB 4.29Å; N107-H110 PolarHBondContact O-N 3.27Å; N107-H110 PolarHBondContact OD1-N 3.49Å; H110-A112 PolarHBondContact O-N 2.67Å; H110-M113 PolarHBondContact O-N 3.04Å; H110-A114 WeakPolarHBondContact O-CB 3.47Å; H110-A114 PolarHBondContact O-N 2.89Å; H110-L167 WeakPolarHBondContact NE2-CD1 3.45Å; H110-A174 HydrophobicContact CB-CB 4.22Å
111	T	97.5	Very high	95.8	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.025	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-43	174.9	-51.6	0	0	0	0	111.7	Y94 F97 Y98 N107 M113 A114 C115 V178	Y94-T111 HydrophobicContact CD2-CG2 4Å; Y94-T111 HydrophobicContact CE2-CG2 4.22Å; F97-T111 HydrophobicContact CD1-CG2 3.52Å; F97-T111 HydrophobicContact CE1-CG2 3.79Å; F97-T111 HydrophobicContact CG-CG2 4.14Å; Y98-T111 HydrophobicContact CE2-CG2 3.66Å; Y98-T111 WeakPolarHBondContact OH-CB 2.98Å; Y98-T111 PolarHBondContact OH-OG1 3.43Å; N107-T111 PolarHBondContact O-N 2.8Å; N107-T111 PolarHBondContact O-OG1 2.9Å; T111-M113 PolarHBondContact O-N 3.31Å; T111-A114 PolarHBondContact O-N 3.3Å; T111-C115 WeakPolarHBondContact O-CB 3.07Å; T111-C115 PolarHBondContact O-N 2.95Å; T111-C115 PolarHBondContact O-SG 3.45Å; T111-V178 HydrophobicContact CG2-CG2 4.08Å
112	A	97.7	Very high	95.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-43.3	177.4	0	0	0	0	0	112.2	I73 Y94 F108 E109 H110 C115 I116 F136	I73-A112 HydrophobicContact CD1-CB 4.43Å; I73-A112 HydrophobicContact CG1-CB 4.05Å; Y94-A112 HydrophobicContact CD2-CB 4.32Å; Y94-A112 HydrophobicContact CE2-CB 4Å; F108-A112 VanDerWaalsContact O-CB 3.24Å; F108-A112 WeakPolarHBondContact O-CB 3.21Å; F108-A112 PolarHBondContact O-N 3.32Å; E109-A112 PolarHBondContact O-N 3.39Å; H110-A112 PolarHBondContact O-N 2.67Å; A112-C115 PolarHBondContact O-N 3.4Å; A112-I116 WeakPolarHBondContact O-CG2 3.21Å; A112-I116 PolarHBondContact O-N 3.32Å; A112-I116 VanDerWaalsContact O-N 3.15Å; A112-F136 HydrophobicContact CB-CE1 4.06Å; A112-F136 HydrophobicContact CB-CZ 4.04Å
113	M	98.1	Very high	95.9	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-59.6	-44.9	172.6	-79.6	-178.2	-95.9	0	0	111.8	E109 H110 T111 I116 Y117 V132 V133 F136 L167 V171	E109-M113 HydrophobicContact CB-CE 4.15Å; E109-M113 VanDerWaalsContact O-CE 3.28Å; E109-M113 WeakPolarHBondContact O-CE 3.36Å; E109-M113 WeakPolarHBondContact O-CG 3.39Å; E109-M113 PolarHBondContact O-N 2.88Å; H110-M113 PolarHBondContact O-N 3.04Å; T111-M113 PolarHBondContact O-N 3.31Å; M113-I116 VanDerWaalsContact O-CG2 3.29Å; M113-I116 WeakPolarHBondContact O-CG2 3.43Å; M113-Y117 VanDerWaalsContact O-CB 3.23Å; M113-Y117 WeakPolarHBondContact O-CB 3.38Å; M113-Y117 PolarHBondContact O-N 3.42Å; M113-V132 HydrophobicContact CB-CG1 4.06Å; M113-V132 HydrophobicContact CG-CG1 4.08Å; M113-V133 HydrophobicContact SD-CG2 4.45Å; M113-F136 HydrophobicContact CB-CE2 4.32Å; M113-F136 HydrophobicContact CB-CZ 4.41Å; M113-F136 HydrophobicContact CE-CB 4.36Å; M113-F136 HydrophobicContact CE-CD1 4.09Å; M113-F136 HydrophobicContact CE-CG 4.3Å; M113-F136 HydrophobicContact CG-CB 4.08Å; M113-F136 HydrophobicContact CG-CD1 3.56Å; M113-F136 HydrophobicContact CG-CD2 3.34Å; M113-F136 HydrophobicContact CG-CE1 3.69Å; M113-F136 HydrophobicContact CG-CE2 3.47Å; M113-F136 VanDerWaalsContact CG-CE2 3.47Å; M113-F136 HydrophobicContact CG-CG 3.36Å; M113-F136 HydrophobicContact CG-CZ 3.65Å; M113-F136 HydrophobicContact SD-CB 3.79Å; M113-F136 HydrophobicContact SD-CD1 4.12Å; M113-F136 HydrophobicContact SD-CD2 4.16Å; M113-F136 HydrophobicContact SD-CG 3.76Å; M113-L167 HydrophobicContact CE-CD1 4.13Å; M113-V171 HydrophobicContact CB-CG1 4.05Å; M113-V171 HydrophobicContact CB-CG2 3.83Å; M113-V171 HydrophobicContact CE-CG2 4.46Å; M113-V171 HydrophobicContact CG-CG2 4.45Å; M113-V171 HydrophobicContact SD-CG2 3.86Å
114	A	98.1	Very high	95.9	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-43.5	178	0	0	0	0	0	112.3	H110 T111 Y117 L118 A174 E175	H110-A114 WeakPolarHBondContact O-CB 3.47Å; H110-A114 PolarHBondContact O-N 2.89Å; T111-A114 PolarHBondContact O-N 3.3Å; A114-Y117 PolarHBondContact O-N 3.08Å; A114-L118 WeakPolarHBondContact O-CB 3.15Å; A114-L118 PolarHBondContact O-N 3.21Å; A114-A174 HydrophobicContact CB-CB 3.8Å; A114-E175 HydrophobicContact CB-CB 4.09Å
115	C	98.2	Very high	96	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-43.6	179.5	-70.3	0	0	0	0	112.5	I73 T111 A112 A119	I73-C115 HydrophobicContact CD1-CB 4.09Å; T111-C115 WeakPolarHBondContact O-CB 3.07Å; T111-C115 PolarHBondContact O-N 2.95Å; T111-C115 PolarHBondContact O-SG 3.45Å; A112-C115 PolarHBondContact O-N 3.4Å; C115-A119 WeakPolarHBondContact O-CB 3.02Å; C115-A119 PolarHBondContact O-N 3.02Å
116	I	98	Very high	96.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-70.9	-35.9	177.1	-169.7	55.1	0	0	0	112	I73 A77 L80 V82 A112 M113 S120 V132 F136	I73-I116 HydrophobicContact CG2-CB 4.33Å; I73-I116 HydrophobicContact CG2-CD1 4.13Å; A77-I116 HydrophobicContact CB-CD1 4.02Å; L80-I116 HydrophobicContact CD1-CG1 4.15Å; V82-I116 HydrophobicContact CG2-CD1 4.01Å; A112-I116 WeakPolarHBondContact O-CG2 3.21Å; A112-I116 PolarHBondContact O-N 3.32Å; A112-I116 VanDerWaalsContact O-N 3.15Å; M113-I116 VanDerWaalsContact O-CG2 3.29Å; M113-I116 WeakPolarHBondContact O-CG2 3.43Å; I116-S120 WeakPolarHBondContact O-CB 3.37Å; I116-S120 PolarHBondContact O-N 2.98Å; I116-V132 HydrophobicContact CG2-CG1 3.93Å; I116-F136 HydrophobicContact CG2-CE2 4.06Å
117	Y	97.9	Very high	96.5	Very high	44 Å²	44	33.4 Å²	33.4	17%	0.173	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-48.6	174	176.9	-120.7	0	0	0	111	M113 A114 S120 K121 R127 I129 V132 E175	M113-Y117 VanDerWaalsContact O-CB 3.23Å; M113-Y117 WeakPolarHBondContact O-CB 3.38Å; M113-Y117 PolarHBondContact O-N 3.42Å; A114-Y117 PolarHBondContact O-N 3.08Å; Y117-S120 PolarHBondContact O-N 2.7Å; Y117-S120 PolarHBondContact O-OG 3.34Å; Y117-K121 PolarHBondContact O-N 3.21Å; Y117-R127 VanDerWaalsContact CE2-O 3.26Å; Y117-R127 WeakPolarHBondContact CE2-O 3.36Å; Y117-I129 HydrophobicContact CE2-CB 4.25Å; Y117-V132 HydrophobicContact CD2-CG2 4.26Å; Y117-E175 VanDerWaalsContact CD1-OE1 3.26Å; Y117-E175 WeakPolarHBondContact CD1-OE1 3.32Å; Y117-E175 WeakPolarHBondContact CE1-OE1 3.37Å; Y117-E175 WeakPolarHBondContact CE1-OE2 3.49Å
118	L	97.6	Very high	96.6	Very high	9 Å²	9	40.6 Å²	40.6	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-46.7	177.3	178.3	57.9	0	0	0	111.9	L93 A114 S120 K121 I122 V178 L179 V186	L93-L118 HydrophobicContact CD1-CD2 4.12Å; L93-L118 HydrophobicContact CD1-CG 4.25Å; A114-L118 WeakPolarHBondContact O-CB 3.15Å; A114-L118 PolarHBondContact O-N 3.21Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 2.93Å; L118-K121 WeakPolarHBondContact O-CA 3.32Å; L118-K121 WeakPolarHBondContact O-CB 3.5Å; L118-K121 PolarHBondContact O-N 3.4Å; L118-I122 HydrophobicContact CD1-CD1 4.11Å; L118-I122 HydrophobicContact CD1-CG1 4.36Å; L118-I122 HydrophobicContact CD2-CD1 4.49Å; L118-I122 HydrophobicContact CG-CD1 3.79Å; L118-I122 WeakPolarHBondContact O-CG1 3.43Å; L118-I122 PolarHBondContact O-N 3.24Å; L118-V178 HydrophobicContact CD2-CG1 3.96Å; L118-L179 HydrophobicContact CD1-CD1 4.37Å; L118-L179 HydrophobicContact CD1-CD2 3.96Å; L118-L179 HydrophobicContact CD1-CG 4.35Å; L118-L179 HydrophobicContact CD2-CD2 3.76Å; L118-L179 HydrophobicContact CD2-CG 4Å; L118-V186 HydrophobicContact CD2-CG1 4.49Å
119	A	97.7	Very high	96.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-35.8	178.2	0	0	0	0	0	112.7	A86 A89 L93 C115 K121 I122 E123	A86-A119 VanDerWaalsContact O-CB 3.28Å; A86-A119 WeakPolarHBondContact O-CB 3.38Å; A89-A119 HydrophobicContact CB-CB 4.14Å; L93-A119 HydrophobicContact CD1-CB 4.4Å; C115-A119 WeakPolarHBondContact O-CB 3.02Å; C115-A119 PolarHBondContact O-N 3.02Å; A119-K121 PolarHBondContact O-N 3.37Å; A119-I122 PolarHBondContact O-N 2.99Å; A119-E123 PolarHBondContact O-N 3.04Å
120	S	97	Very high	96.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-31.5	173.8	80.7	0	0	0	0	112.6	I116 Y117 L118 T125 P126 R127	I116-S120 WeakPolarHBondContact O-CB 3.37Å; I116-S120 PolarHBondContact O-N 2.98Å; Y117-S120 PolarHBondContact O-N 2.7Å; Y117-S120 PolarHBondContact O-OG 3.34Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 2.93Å; S120-T125 WeakPolarHBondContact CB-O 3.47Å; S120-T125 CarbonylContact O-C 2.97Å; S120-T125 WeakPolarHBondContact O-CA 3.22Å; S120-T125 PolarHBondContact O-N 2.74Å; S120-P126 WeakPolarHBondContact O-CA 2.98Å; S120-P126 VanDerWaalsContact O-N 3.11Å; S120-R127 PolarHBondContact OG-N 2.9Å
121	K	96.6	Very high	96.6	Very high	73 Å²	73	46.8 Å²	46.8	32%	0.317	21%	0.214	S	C	.	.	H	α-helix	trans	-75.6	-44	174.8	-65.4	-173.6	-69.8	-178.8	0	111.7	Y117 L118 A119 E123 E124 P126 E175	Y117-K121 PolarHBondContact O-N 3.21Å; L118-K121 WeakPolarHBondContact O-CA 3.32Å; L118-K121 WeakPolarHBondContact O-CB 3.5Å; L118-K121 PolarHBondContact O-N 3.4Å; A119-K121 PolarHBondContact O-N 3.37Å; K121-E123 VanDerWaalsContact C-N 3.33Å; K121-E123 PolarHBondContact O-N 3.41Å; K121-E124 PolarHBondContact O-N 2.88Å; K121-P126 HydrophobicContact CG-CB 4.35Å; K121-E175 WeakPolarHBondContact CE-OE1 3.4Å; K121-E175 IonicContact NZ-OE1 3.17Å; K121-E175 PolarHBondContact NZ-OE1 3.49Å; K121-E175 IonicContact NZ-OE2 3.41Å; K121-E175 PolarHBondContact NZ-OE2 2.94Å; K121-E175 VanDerWaalsContact NZ-OE2 3.17Å
122	I	95.7	Very high	96.6	Very high	51 Å²	51	46.6 Å²	46.6	26%	0.262	21%	0.213	S	C	.	.	H	α-helix	trans	-61.3	-41.9	-179.3	-66.8	160	0	0	0	111.6	L93 L118 A119 E124 V186	L93-I122 HydrophobicContact CD1-CD1 3.8Å; L118-I122 HydrophobicContact CD1-CD1 4.11Å; L118-I122 HydrophobicContact CD1-CG1 4.36Å; L118-I122 HydrophobicContact CD2-CD1 4.49Å; L118-I122 HydrophobicContact CG-CD1 3.79Å; L118-I122 WeakPolarHBondContact O-CG1 3.43Å; L118-I122 PolarHBondContact O-N 3.24Å; A119-I122 PolarHBondContact O-N 2.99Å; I122-E124 PolarHBondContact O-N 3.13Å; I122-V186 HydrophobicContact CD1-CB 3.61Å; I122-V186 HydrophobicContact CD1-CG1 4.25Å; I122-V186 HydrophobicContact CD1-CG2 3.74Å; I122-V186 HydrophobicContact CG1-CB 4.44Å; I122-V186 HydrophobicContact CG1-CG2 4.01Å
123	E	95	Very high	96.5	Very high	65 Å²	65	46.7 Å²	46.7	30%	0.304	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	23.7	-179.9	-65.6	-64.5	150.5	0	0	112.8	V85 A86 A89 A119 K121 T125	V85-E123 HydrophobicContact CG1-CG 4.37Å; V85-E123 WeakPolarHBondContact CG1-OE2 3.36Å; A86-E123 HydrophobicContact CB-CB 3.89Å; A86-E123 HydrophobicContact CB-CG 3.95Å; A89-E123 HydrophobicContact CB-CG 4.43Å; A119-E123 PolarHBondContact O-N 3.04Å; K121-E123 VanDerWaalsContact C-N 3.33Å; K121-E123 PolarHBondContact O-N 3.41Å; E123-T125 PolarHBondContact O-N 3.36Å; E123-T125 PolarHBondContact O-OG1 3.41Å
124	E	94.7	Very high	96.3	Very high	161 Å²	161	49.3 Å²	49.3	75%	0.752	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	31.6	175.1	-61.4	-60.7	147.7	0	0	114.2	K121 I122	K121-E124 PolarHBondContact O-N 2.88Å; I122-E124 PolarHBondContact O-N 3.13Å
125	T	94.7	Very high	96.2	Very high	38 Å²	38	50.3 Å²	50.3	23%	0.233	23%	0.233	C	C	.	.			trans	-128.8	53.5	177.5	49.5	0	0	0	0	111.4	P83 S120 E123 R127	P83-T125 WeakPolarHBondContact CD-OG1 3.2Å; P83-T125 HydrophobicContact CG-CG2 4.01Å; S120-T125 WeakPolarHBondContact CB-O 3.47Å; S120-T125 CarbonylContact O-C 2.97Å; S120-T125 WeakPolarHBondContact O-CA 3.22Å; S120-T125 PolarHBondContact O-N 2.74Å; E123-T125 PolarHBondContact O-N 3.36Å; E123-T125 PolarHBondContact O-OG1 3.41Å; T125-R127 PolarHBondContact O-NH1 2.85Å
126	P	95.6	Very high	96	Very high	80 Å²	80	50.6 Å²	50.6	52%	0.519	24%	0.235	S	C	.	.			trans	-59.7	144.3	-168	25.2	-35.4	0	0	0	112.1	S120 K121	S120-P126 WeakPolarHBondContact O-CA 2.98Å; S120-P126 VanDerWaalsContact O-N 3.11Å; K121-P126 HydrophobicContact CG-CB 4.35Å
127	R	96.2	Very high	95.7	Very high	68 Å²	68	52.9 Å²	52.9	26%	0.257	25%	0.245	S	C	.	.			trans	-117.1	151.6	172.5	-65	-66.7	177.6	-89.7	0.3	110.1	L80 R81 V82 Y117 S120 T125 V132	L80-R127 HydrophobicContact CB-CG 4.48Å; L80-R127 PolarHBondContact O-NE 3.02Å; R81-R127 PolarHBondContact O-NH2 2.94Å; V82-R127 HydrophobicContact CG1-CG 3.55Å; Y117-R127 VanDerWaalsContact CE2-O 3.26Å; Y117-R127 WeakPolarHBondContact CE2-O 3.36Å; S120-R127 PolarHBondContact OG-N 2.9Å; T125-R127 PolarHBondContact O-NH1 2.85Å; R127-V132 HydrophobicContact CB-CG2 4.49Å
128	R	95.9	Very high	95.4	Very high	180 Å²	180	52.9 Å²	52.9	68%	0.679	25%	0.246	S	C	*	.			trans	-72.7	140.9	176	-59.2	177.8	175.1	-173.3	-2.1	108.7	R130 D131 V132	R128-R130 PolarHBondContact O-N 3.43Å; R128-R130 VanDerWaalsContact O-N 3.16Å; R128-D131 WeakPolarHBondContact CB-OD2 3.06Å; R128-D131 WeakPolarHBondContact O-CB 3.46Å; R128-D131 PolarHBondContact O-N 3.21Å; R128-V132 PolarHBondContact O-N 3.23Å
129	I	95.7	Very high	95.1	Very high	21 Å²	21	52.7 Å²	52.7	11%	0.108	25%	0.245	C	C	.	.	H	α-helix	trans	-56.7	-34.3	177.7	-168.8	166.5	0	0	0	112.6	Y117 D131 V132 V133 K168 V171 I172	Y117-I129 HydrophobicContact CE2-CB 4.25Å; I129-D131 VanDerWaalsContact C-N 3.27Å; I129-D131 PolarHBondContact O-N 3.25Å; I129-V132 PolarHBondContact O-N 3.19Å; I129-V133 HydrophobicContact CG1-CG2 4.35Å; I129-V133 WeakPolarHBondContact O-CG2 3.28Å; I129-V133 PolarHBondContact O-N 2.99Å; I129-K168 HydrophobicContact CD1-CG 3.89Å; I129-K168 HydrophobicContact CG1-CG 4.31Å; I129-K168 HydrophobicContact CG2-CD 4.26Å; I129-K168 HydrophobicContact CG2-CG 4.11Å; I129-V171 HydrophobicContact CD1-CB 4.13Å; I129-V171 HydrophobicContact CD1-CG1 3.88Å; I129-V171 HydrophobicContact CG1-CG1 4.2Å; I129-I172 HydrophobicContact CD1-CD1 4.03Å; I129-I172 HydrophobicContact CD1-CG1 3.47Å; I129-I172 VanDerWaalsContact CD1-CG1 3.47Å
130	R	95.2	Very high	94.6	Very high	123 Å²	123	56.4 Å²	56.4	46%	0.464	26%	0.262	S	S	.	.	H	α-helix	trans	-56.3	-42	173.2	-178.5	-175.9	-66.1	150.4	-1.2	111.8	R128 V133 N134 Y164	R128-R130 PolarHBondContact O-N 3.43Å; R128-R130 VanDerWaalsContact O-N 3.16Å; R130-V133 PolarHBondContact O-N 3.12Å; R130-N134 VanDerWaalsContact O-CB 3.32Å; R130-N134 WeakPolarHBondContact O-CB 3.35Å; R130-N134 PolarHBondContact O-N 3.31Å; R130-N134 PolarHBondContact O-ND2 2.85Å; R130-Y164 WeakPolarHBondContact CB-OH 2.97Å
131	D	95.9	Very high	94	Very high	62 Å²	62	57.6 Å²	57.6	33%	0.332	27%	0.267	S	S	.	.	H	α-helix	trans	-69.3	-40.5	-177.5	-55.7	-25.3	0	0	0	110.3	L80 R128 I129 N134 V135	L80-D131 HydrophobicContact CD2-CB 3.92Å; R128-D131 WeakPolarHBondContact CB-OD2 3.06Å; R128-D131 WeakPolarHBondContact O-CB 3.46Å; R128-D131 PolarHBondContact O-N 3.21Å; I129-D131 VanDerWaalsContact C-N 3.27Å; I129-D131 PolarHBondContact O-N 3.25Å; D131-N134 PolarHBondContact O-N 3.42Å; D131-V135 WeakPolarHBondContact O-CB 3.46Å; D131-V135 WeakPolarHBondContact O-CG2 3.45Å; D131-V135 PolarHBondContact O-N 3.31Å
132	V	96.8	Very high	93.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-51	174.7	179.8	0	0	0	0	110.5	L80 M113 I116 Y117 R127 R128 I129 N134 V135 F136	L80-V132 HydrophobicContact CD1-CG2 3.99Å; L80-V132 HydrophobicContact CD2-CG2 4.47Å; M113-V132 HydrophobicContact CB-CG1 4.06Å; M113-V132 HydrophobicContact CG-CG1 4.08Å; I116-V132 HydrophobicContact CG2-CG1 3.93Å; Y117-V132 HydrophobicContact CD2-CG2 4.26Å; R127-V132 HydrophobicContact CB-CG2 4.49Å; R128-V132 PolarHBondContact O-N 3.23Å; I129-V132 PolarHBondContact O-N 3.19Å; V132-N134 PolarHBondContact O-N 2.9Å; V132-V135 PolarHBondContact O-N 3.06Å; V132-F136 HydrophobicContact CG1-CD2 4.19Å; V132-F136 HydrophobicContact CG1-CE2 4.24Å; V132-F136 WeakPolarHBondContact O-CD2 3.46Å; V132-F136 PolarHBondContact O-N 3.36Å
133	V	96	Very high	92.4	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-42.3	-179.1	171	0	0	0	0	111.3	M113 I129 R130 V135 F136 H137 M158 Y164 L167 V171	M113-V133 HydrophobicContact SD-CG2 4.45Å; I129-V133 HydrophobicContact CG1-CG2 4.35Å; I129-V133 WeakPolarHBondContact O-CG2 3.28Å; I129-V133 PolarHBondContact O-N 2.99Å; R130-V133 PolarHBondContact O-N 3.12Å; V133-V135 VanDerWaalsContact C-N 3.34Å; V133-V135 PolarHBondContact O-N 3.25Å; V133-F136 PolarHBondContact O-N 3.29Å; V133-H137 WeakPolarHBondContact O-CB 3.48Å; V133-H137 PolarHBondContact O-N 3.16Å; V133-M158 HydrophobicContact CG1-CE 3.39Å; V133-M158 HydrophobicContact CG1-SD 3.38Å; V133-M158 WeakPolarHBondContact CG1-SD 3.44Å; V133-M158 WeakPolarHBondContact O-CE 3.45Å; V133-Y164 HydrophobicContact CB-CE2 4.45Å; V133-Y164 HydrophobicContact CG1-CD2 3.98Å; V133-Y164 HydrophobicContact CG1-CE2 3.95Å; V133-L167 HydrophobicContact CG1-CD2 3.74Å; V133-L167 HydrophobicContact CG1-CG 4.34Å; V133-V171 HydrophobicContact CG2-CG2 4.42Å
134	N	94.5	Very high	91.4	Very high	58 Å²	58	58.7 Å²	58.7	31%	0.31	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-41.6	174.6	-76	-17.7	0	0	0	112.4	R130 D131 V132 H137 H138 M158	R130-N134 VanDerWaalsContact O-CB 3.32Å; R130-N134 WeakPolarHBondContact O-CB 3.35Å; R130-N134 PolarHBondContact O-N 3.31Å; R130-N134 PolarHBondContact O-ND2 2.85Å; D131-N134 PolarHBondContact O-N 3.42Å; V132-N134 PolarHBondContact O-N 2.9Å; N134-H137 PolarHBondContact O-N 3.33Å; N134-H138 WeakPolarHBondContact O-CB 3.44Å; N134-H138 PolarHBondContact O-N 3.25Å; N134-M158 WeakPolarHBondContact OD1-CB 3.38Å
135	V	94.7	Very high	90.2	Very high	20 Å²	20	52.9 Å²	52.9	12%	0.121	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-46.4	178.8	161.4	0	0	0	0	111.3	A76 L79 L80 D131 V132 V133 H137 H138 M139	A76-V135 HydrophobicContact CB-CG1 3.94Å; L79-V135 HydrophobicContact CB-CB 4.49Å; L79-V135 HydrophobicContact CB-CG1 3.63Å; L79-V135 HydrophobicContact CB-CG2 4Å; L79-V135 HydrophobicContact CD1-CG1 3.76Å; L79-V135 HydrophobicContact CG-CG1 4.35Å; L80-V135 HydrophobicContact CD2-CB 4.22Å; L80-V135 HydrophobicContact CD2-CG2 3.63Å; L80-V135 HydrophobicContact CG-CB 4.28Å; L80-V135 HydrophobicContact CG-CG1 4.32Å; L80-V135 HydrophobicContact CG-CG2 3.91Å; D131-V135 WeakPolarHBondContact O-CB 3.46Å; D131-V135 WeakPolarHBondContact O-CG2 3.45Å; D131-V135 PolarHBondContact O-N 3.31Å; V132-V135 PolarHBondContact O-N 3.06Å; V133-V135 VanDerWaalsContact C-N 3.34Å; V133-V135 PolarHBondContact O-N 3.25Å; V135-H137 VanDerWaalsContact C-N 3.29Å; V135-H137 PolarHBondContact O-N 2.84Å; V135-H138 WeakPolarHBondContact O-CB 3.28Å; V135-H138 PolarHBondContact O-N 3.38Å; V135-M139 HydrophobicContact CG1-SD 3.91Å; V135-M139 VanDerWaalsContact O-CG 3.28Å; V135-M139 WeakPolarHBondContact O-CG 3.43Å; V135-M139 PolarHBondContact O-N 3.31Å
136	F	94.5	Very high	89	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-36.3	177.3	-89.9	-104.2	0	0	0	112.3	L72 A76 A112 M113 I116 V132 V133 M139 K140	L72-F136 HydrophobicContact CB-CE1 4.18Å; A76-F136 HydrophobicContact CB-CD2 4.14Å; A76-F136 HydrophobicContact CB-CE2 3.5Å; A76-F136 VanDerWaalsContact CB-CE2 3.5Å; A76-F136 HydrophobicContact CB-CZ 4.07Å; A112-F136 HydrophobicContact CB-CE1 4.06Å; A112-F136 HydrophobicContact CB-CZ 4.04Å; M113-F136 HydrophobicContact CB-CE2 4.32Å; M113-F136 HydrophobicContact CB-CZ 4.41Å; M113-F136 HydrophobicContact CE-CB 4.36Å; M113-F136 HydrophobicContact CE-CD1 4.09Å; M113-F136 HydrophobicContact CE-CG 4.3Å; M113-F136 HydrophobicContact CG-CB 4.08Å; M113-F136 HydrophobicContact CG-CD1 3.56Å; M113-F136 HydrophobicContact CG-CD2 3.34Å; M113-F136 HydrophobicContact CG-CE1 3.69Å; M113-F136 HydrophobicContact CG-CE2 3.47Å; M113-F136 VanDerWaalsContact CG-CE2 3.47Å; M113-F136 HydrophobicContact CG-CG 3.36Å; M113-F136 HydrophobicContact CG-CZ 3.65Å; M113-F136 HydrophobicContact SD-CB 3.79Å; M113-F136 HydrophobicContact SD-CD1 4.12Å; M113-F136 HydrophobicContact SD-CD2 4.16Å; M113-F136 HydrophobicContact SD-CG 3.76Å; I116-F136 HydrophobicContact CG2-CE2 4.06Å; V132-F136 HydrophobicContact CG1-CD2 4.19Å; V132-F136 HydrophobicContact CG1-CE2 4.24Å; V132-F136 WeakPolarHBondContact O-CD2 3.46Å; V132-F136 PolarHBondContact O-N 3.36Å; V133-F136 PolarHBondContact O-N 3.29Å; F136-M139 PolarHBondContact O-N 3.15Å; F136-K140 WeakPolarHBondContact O-CG 2.92Å; F136-K140 PolarHBondContact O-N 2.96Å
137	H	92.3	Very high	87.5	Confident	49 Å²	49	56.4 Å²	56.4	23%	0.227	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-40.2	173.5	-179.7	75.7	0	0	0	112.8	V133 N134 V135 M139 K140 Q141 M158	V133-H137 WeakPolarHBondContact O-CB 3.48Å; V133-H137 PolarHBondContact O-N 3.16Å; N134-H137 PolarHBondContact O-N 3.33Å; V135-H137 VanDerWaalsContact C-N 3.29Å; V135-H137 PolarHBondContact O-N 2.84Å; H137-M139 VanDerWaalsContact C-N 3.33Å; H137-M139 PolarHBondContact O-N 3.36Å; H137-K140 PolarHBondContact O-N 3.36Å; H137-Q141 PolarHBondContact CD2-NE2 3.33Å; H137-Q141 PolarHBondContact NE2-NE2 2.88Å; H137-Q141 WeakPolarHBondContact O-CG 3.38Å; H137-Q141 PolarHBondContact O-N 2.98Å; H137-M158 HydrophobicContact CB-CE 3.09Å; H137-M158 VanDerWaalsContact CG-CE 3.44Å
138	H	91	Very high	86	Confident	43 Å²	43	56.4 Å²	56.4	20%	0.199	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-42.7	172.3	179.7	52.3	0	0	0	111.6	N134 V135 K140 Q141 L142 F155	N134-H138 WeakPolarHBondContact O-CB 3.44Å; N134-H138 PolarHBondContact O-N 3.25Å; V135-H138 WeakPolarHBondContact O-CB 3.28Å; V135-H138 PolarHBondContact O-N 3.38Å; H138-K140 VanDerWaalsContact C-N 3.35Å; H138-K140 PolarHBondContact O-N 3.47Å; H138-Q141 WeakPolarHBondContact O-CB 3.46Å; H138-Q141 PolarHBondContact O-N 2.89Å; H138-Q141 VanDerWaalsContact O-N 3.15Å; H138-L142 WeakPolarHBondContact O-CG 3.33Å; H138-L142 PolarHBondContact O-N 2.93Å; H138-F155 AromaticContact CE1-CD2 3.91Å; H138-F155 AromaticContact CE1-CE2 3.94Å; H138-F155 AromaticContact CE1-CG 3.96Å; H138-F155 AromaticContact ND1-CD1 3.91Å; H138-F155 AromaticContact ND1-CG 3.97Å
139	M	90.5	Very high	84.2	Confident	5 Å²	5	56 Å²	56	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-41.5	175.2	-69.2	167.3	58.2	0	0	112.4	L72 T75 A76 L79 V135 F136 H137 Q141 L142 H143	L72-M139 HydrophobicContact CB-CE 4.22Å; L72-M139 HydrophobicContact CD2-CE 3.5Å; L72-M139 HydrophobicContact CG-CE 4.48Å; T75-M139 HydrophobicContact CG2-CE 3.85Å; T75-M139 HydrophobicContact CG2-CG 4.19Å; T75-M139 HydrophobicContact CG2-SD 4.08Å; A76-M139 HydrophobicContact CB-SD 3.94Å; L79-M139 HydrophobicContact CD1-CG 3.54Å; L79-M139 HydrophobicContact CD1-SD 4Å; V135-M139 HydrophobicContact CG1-SD 3.91Å; V135-M139 VanDerWaalsContact O-CG 3.28Å; V135-M139 WeakPolarHBondContact O-CG 3.43Å; V135-M139 PolarHBondContact O-N 3.31Å; F136-M139 PolarHBondContact O-N 3.15Å; H137-M139 VanDerWaalsContact C-N 3.33Å; H137-M139 PolarHBondContact O-N 3.36Å; M139-Q141 VanDerWaalsContact C-N 3.31Å; M139-Q141 PolarHBondContact O-N 3.29Å; M139-L142 PolarHBondContact O-N 2.99Å; M139-H143 PolarHBondContact O-N 3.11Å
140	K	87	Confident	82.3	Confident	78 Å²	78	63.4 Å²	63.4	34%	0.339	30%	0.3	S	S	.	.	H	α-helix	trans	-60.9	-40.4	173.8	-75.8	-177.9	176.2	-173.9	0	112	E109 F136 H137 H138 R144	E109-K140 VanDerWaalsContact CD-CE 3.46Å; E109-K140 WeakPolarHBondContact OE1-CE 3.44Å; E109-K140 IonicContact OE1-NZ 3.95Å; E109-K140 PolarHBondContact OE1-NZ 3.37Å; E109-K140 VanDerWaalsContact OE2-CE 3.26Å; E109-K140 WeakPolarHBondContact OE2-CE 3.34Å; E109-K140 IonicContact OE2-NZ 3.86Å; E109-K140 PolarHBondContact OE2-NZ 2.9Å; F136-K140 WeakPolarHBondContact O-CG 2.92Å; F136-K140 PolarHBondContact O-N 2.96Å; H137-K140 PolarHBondContact O-N 3.36Å; H138-K140 VanDerWaalsContact C-N 3.35Å; H138-K140 PolarHBondContact O-N 3.47Å; K140-R144 WeakPolarHBondContact O-CG 3.35Å; K140-R144 PolarHBondContact O-N 3Å
141	Q	84.9	Confident	80.3	Confident	27 Å²	27	62.8 Å²	62.8	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-66.6	-41.3	175.6	-67.2	177.7	50.1	0	0	112.1	H137 H138 M139 H143 R144 V145 F155 S156	H137-Q141 PolarHBondContact CD2-NE2 3.33Å; H137-Q141 PolarHBondContact NE2-NE2 2.88Å; H137-Q141 WeakPolarHBondContact O-CG 3.38Å; H137-Q141 PolarHBondContact O-N 2.98Å; H138-Q141 WeakPolarHBondContact O-CB 3.46Å; H138-Q141 PolarHBondContact O-N 2.89Å; H138-Q141 VanDerWaalsContact O-N 3.15Å; M139-Q141 VanDerWaalsContact C-N 3.31Å; M139-Q141 PolarHBondContact O-N 3.29Å; Q141-H143 VanDerWaalsContact C-N 3.35Å; Q141-H143 PolarHBondContact O-N 3.48Å; Q141-R144 PolarHBondContact O-N 3.36Å; Q141-R144 VanDerWaalsContact O-N 3.15Å; Q141-V145 WeakPolarHBondContact O-CG2 2.93Å; Q141-V145 PolarHBondContact O-N 3.04Å; Q141-F155 HydrophobicContact CB-CD1 3.78Å; Q141-F155 HydrophobicContact CB-CE1 4.16Å; Q141-S156 PolarHBondContact NE2-O 2.76Å
142	L	81.8	Confident	78.4	Confident	28 Å²	28	68 Å²	68	15%	0.147	33%	0.328	C	S	.	.	H	α-helix	trans	-57.3	-47	176	-74.5	170.2	0	0	0	111.6	H138 M139 R144 V145 D146 F155 V408	H138-L142 WeakPolarHBondContact O-CG 3.33Å; H138-L142 PolarHBondContact O-N 2.93Å; M139-L142 PolarHBondContact O-N 2.99Å; L142-R144 VanDerWaalsContact C-N 3.27Å; L142-R144 PolarHBondContact O-N 3.45Å; L142-V145 PolarHBondContact O-N 3.37Å; L142-V145 VanDerWaalsContact O-N 3.12Å; L142-D146 PolarHBondContact O-N 3.4Å; L142-F155 HydrophobicContact CD2-CE1 3.76Å; L142-F155 HydrophobicContact CD2-CE2 4.36Å; L142-F155 HydrophobicContact CD2-CZ 3.41Å; L142-F155 VanDerWaalsContact CD2-CZ 3.41Å; L142-F155 HydrophobicContact CG-CE1 4.15Å; L142-F155 HydrophobicContact CG-CZ 4.26Å; L142-V408 HydrophobicContact CD1-CG1 4.32Å
143	H	76.8	Confident	76.7	Confident	57 Å²	57	76 Å²	76	26%	0.264	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-33.2	177.5	-66.8	157.7	0	0	0	113.4	M139 Q141 Q147	M139-H143 PolarHBondContact O-N 3.11Å; Q141-H143 VanDerWaalsContact C-N 3.35Å; Q141-H143 PolarHBondContact O-N 3.48Å; H143-Q147 VanDerWaalsContact O-CG 3.28Å; H143-Q147 WeakPolarHBondContact O-CG 3.07Å; H143-Q147 PolarHBondContact O-N 2.94Å
144	R	73.7	Confident	75.2	Confident	126 Å²	126	87.4 Å²	87.4	48%	0.475	41%	0.405	S	S	.	.	H	α-helix	trans	-70.8	-37.8	175.2	-68.4	-177.3	-171.8	-164.6	9.7	111.9	K140 Q141 L142 S148 E326	K140-R144 WeakPolarHBondContact O-CG 3.35Å; K140-R144 PolarHBondContact O-N 3Å; Q141-R144 PolarHBondContact O-N 3.36Å; Q141-R144 VanDerWaalsContact O-N 3.15Å; L142-R144 VanDerWaalsContact C-N 3.27Å; L142-R144 PolarHBondContact O-N 3.45Å; R144-S148 WeakPolarHBondContact O-CB 3.35Å; R144-S148 PolarHBondContact O-N 3.13Å; R144-S148 VanDerWaalsContact O-N 3.13Å; R144-E326 IonicContact CZ-OE2 3.61Å; R144-E326 IonicContact NH1-OE2 3.61Å; R144-E326 IonicContact NH2-OE2 2.73Å; R144-E326 PolarHBondContact NH2-OE2 2.9Å
145	V	70.1	Confident	74.4	Confident	40 Å²	40	86.6 Å²	86.6	24%	0.242	40%	0.399	C	S	.	.	H	α-helix	trans	-67.5	-45.8	178.1	174.5	0	0	0	0	110.8	Q141 L142 Q147 S148 H149 F155	Q141-V145 WeakPolarHBondContact O-CG2 2.93Å; Q141-V145 PolarHBondContact O-N 3.04Å; L142-V145 PolarHBondContact O-N 3.37Å; L142-V145 VanDerWaalsContact O-N 3.12Å; V145-Q147 PolarHBondContact O-N 2.68Å; V145-S148 PolarHBondContact O-N 3.12Å; V145-H149 PolarHBondContact O-N 3.24Å; V145-F155 HydrophobicContact CG2-CE1 4.14Å
146	D	69.1	Low	73.7	Confident	85 Å²	85	88.8 Å²	88.8	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-58.3	-34.3	178.8	-77.2	-11.1	0	0	0	112.1	L142	L142-D146 PolarHBondContact O-N 3.4Å
147	Q	65.2	Low	73.2	Confident	106 Å²	106	94 Å²	94	50%	0.495	45%	0.45	S	S	.	.	H	α-helix	trans	-79	-35.5	178.6	-70.5	171.5	13.9	0	0	113.4	H143 V145 H149 I287	H143-Q147 VanDerWaalsContact O-CG 3.28Å; H143-Q147 WeakPolarHBondContact O-CG 3.07Å; H143-Q147 PolarHBondContact O-N 2.94Å; V145-Q147 PolarHBondContact O-N 2.68Å; Q147-H149 VanDerWaalsContact C-N 3.33Å; Q147-I287 VanDerWaalsContact OE1-CD1 3.24Å
148	S	63.5	Low	72.8	Confident	68 Å²	68	92.8 Å²	92.8	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-75.6	-23.4	-174.5	-172.6	0	0	0	0	112.3	R144 V145 K150	R144-S148 WeakPolarHBondContact O-CB 3.35Å; R144-S148 PolarHBondContact O-N 3.13Å; R144-S148 VanDerWaalsContact O-N 3.13Å; V145-S148 PolarHBondContact O-N 3.12Å; S148-K150 VanDerWaalsContact O-CB 3.25Å; S148-K150 WeakPolarHBondContact O-CB 3.4Å; S148-K150 WeakPolarHBondContact O-CG 3.48Å; S148-K150 PolarHBondContact O-N 3.27Å
149	H	60.2	Low	72.6	Confident	173 Å²	173	94.2 Å²	94.2	80%	0.801	46%	0.458	S	S	*	.			trans	49.5	-2.3	-176.5	-82.7	-69.6	0	0	0	116.1	V145 Q147	V145-H149 PolarHBondContact O-N 3.24Å; Q147-H149 VanDerWaalsContact C-N 3.33Å
150	K	54	Low	72.5	Confident	176 Å²	176	99.9 Å²	99.9	77%	0.765	49%	0.488	S	S	*	.	S	Bend	trans	-127.9	-8.1	-159.1	-77	-174.9	174	-179.6	0	115.9	S148	S148-K150 VanDerWaalsContact O-CB 3.25Å; S148-K150 WeakPolarHBondContact O-CB 3.4Å; S148-K150 WeakPolarHBondContact O-CG 3.48Å; S148-K150 PolarHBondContact O-N 3.27Å
151	D	54.6	Low	72.6	Confident	110 Å²	110	99.4 Å²	99.4	59%	0.588	49%	0.489	S	S	*	.			trans	-146.2	115.8	175	-84	-45.5	0	0	0	111.7	K153	D151-K153 PolarHBondContact O-N 2.91Å
152	H	56.2	Low	73	Confident	172 Å²	172	105.2 Å²	105.2	80%	0.796	52%	0.515	S	S	*	.			trans	-73.5	58.7	164.6	-69.9	61.6	0	0	0	109.1	R154	H152-R154 PolarHBondContact O-N 3.13Å
153	K	59.5	Low	73.4	Confident	167 Å²	167	109.4 Å²	109.4	73%	0.726	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-63.6	126.7	178.1	-143.4	170	-172.1	174.7	0	107.1	D151 F155	D151-K153 PolarHBondContact O-N 2.91Å; K153-F155 PolarHBondContact O-N 3.38Å; K153-F155 VanDerWaalsContact O-N 3.13Å
154	R	65	Low	74.2	Confident	240 Å²	240	107.8 Å²	107.8	91%	0.906	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-52.5	123.1	178.8	-69.3	-177.7	177.8	-177.4	0.3	108.5	H152 S156	H152-R154 PolarHBondContact O-N 3.13Å; R154-S156 PolarHBondContact O-N 3.3Å; R154-S156 VanDerWaalsContact O-N 3.15Å
155	F	78.2	Confident	75.2	Confident	42 Å²	42	105.2 Å²	105.2	18%	0.184	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-51.5	122.7	176	-63	-67.9	0	0	0	109.8	H138 Q141 L142 V145 K153	H138-F155 AromaticContact CE1-CD2 3.91Å; H138-F155 AromaticContact CE1-CE2 3.94Å; H138-F155 AromaticContact CE1-CG 3.96Å; H138-F155 AromaticContact ND1-CD1 3.91Å; H138-F155 AromaticContact ND1-CG 3.97Å; Q141-F155 HydrophobicContact CB-CD1 3.78Å; Q141-F155 HydrophobicContact CB-CE1 4.16Å; L142-F155 HydrophobicContact CD2-CE1 3.76Å; L142-F155 HydrophobicContact CD2-CE2 4.36Å; L142-F155 HydrophobicContact CD2-CZ 3.41Å; L142-F155 VanDerWaalsContact CD2-CZ 3.41Å; L142-F155 HydrophobicContact CG-CE1 4.15Å; L142-F155 HydrophobicContact CG-CZ 4.26Å; V145-F155 HydrophobicContact CG2-CE1 4.14Å; K153-F155 PolarHBondContact O-N 3.38Å; K153-F155 VanDerWaalsContact O-N 3.13Å
156	S	80.2	Confident	76.4	Confident	66 Å²	66	105.4 Å²	105.4	46%	0.462	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-78.7	132.4	177.6	55	0	0	0	0	109	Q141 R154	Q141-S156 PolarHBondContact NE2-O 2.76Å; R154-S156 PolarHBondContact O-N 3.3Å; R154-S156 VanDerWaalsContact O-N 3.15Å
157	P	83.7	Confident	77.7	Confident	115 Å²	115	103.4 Å²	103.4	75%	0.747	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-54.5	149.4	166.2	-21.9	32.7	0	0	0	110.1	P159	P157-P159 WeakPolarHBondContact O-CD 3.36Å
158	M	84.6	Confident	79.1	Confident	25 Å²	25	101.9 Å²	101.9	12%	0.123	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-59.3	125.5	174.5	175.8	170.5	-73.2	0	0	110.2	V133 N134 H137 L160 Y164	V133-M158 HydrophobicContact CG1-CE 3.39Å; V133-M158 HydrophobicContact CG1-SD 3.38Å; V133-M158 WeakPolarHBondContact CG1-SD 3.44Å; V133-M158 WeakPolarHBondContact O-CE 3.45Å; N134-M158 WeakPolarHBondContact OD1-CB 3.38Å; H137-M158 HydrophobicContact CB-CE 3.09Å; H137-M158 VanDerWaalsContact CG-CE 3.44Å; M158-L160 PolarHBondContact O-N 2.89Å; M158-Y164 HydrophobicContact CG-CD2 4.36Å; M158-Y164 HydrophobicContact SD-CD2 3.34Å; M158-Y164 WeakPolarHBondContact SD-CD2 3.49Å; M158-Y164 HydrophobicContact SD-CE2 3.96Å; M158-Y164 HydrophobicContact SD-CG 4.28Å
159	P	85.7	Confident	80.7	Confident	73 Å²	73	102.2 Å²	102.2	47%	0.474	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-60.9	130.9	170.9	-21.1	33.4	0	0	0	110.3	P157 D161 Y164	P157-P159 WeakPolarHBondContact O-CD 3.36Å; P159-D161 PolarHBondContact O-N 3.38Å; P159-Y164 WeakPolarHBondContact O-CB 3.33Å
160	L	88.6	Confident	82.5	Confident	124 Å²	124	95.3 Å²	95.3	65%	0.649	47%	0.466	S	S	*	.			trans	-90.9	53.5	177	-60.9	178.8	0	0	0	110.6	M158 Y164	M158-L160 PolarHBondContact O-N 2.89Å; L160-Y164 HydrophobicContact CD2-CD1 3.87Å; L160-Y164 HydrophobicContact CD2-CD2 4.31Å; L160-Y164 HydrophobicContact CD2-CE1 3.92Å; L160-Y164 HydrophobicContact CD2-CE2 4.31Å; L160-Y164 HydrophobicContact CD2-CG 4.06Å
161	D	89.8	Confident	84.5	Confident	67 Å²	67	87 Å²	87	36%	0.358	43%	0.43	S	S	.	.	S	Bend	trans	-94.9	-171.4	-178.9	64.1	6.5	0	0	0	111.8	P159 R163 Y164 V165	P159-D161 PolarHBondContact O-N 3.38Å; D161-R163 PolarHBondContact O-N 3.49Å; D161-R163 WeakPolarHBondContact OD1-CA 3.43Å; D161-R163 VanDerWaalsContact OD1-CB 3.27Å; D161-R163 WeakPolarHBondContact OD1-CB 3.41Å; D161-R163 PolarHBondContact OD1-N 2.93Å; D161-Y164 PolarHBondContact O-N 3.49Å; D161-Y164 PolarHBondContact OD1-N 3.29Å; D161-Y164 VanDerWaalsContact OD1-N 3.07Å; D161-V165 PolarHBondContact O-N 2.57Å
162	H	92.5	Very high	86.6	Confident	149 Å²	149	83.7 Å²	83.7	69%	0.69	41%	0.412	S	S	*	.	H	α-helix	trans	-56.3	-35.1	175.3	-175.9	-84.9	0	0	0	112.3	Y164 V165 T166	H162-Y164 PolarHBondContact O-N 2.96Å; H162-V165 PolarHBondContact O-N 3.24Å; H162-V165 VanDerWaalsContact O-N 3.12Å; H162-T166 PolarHBondContact CE1-OG1 2.95Å; H162-T166 PolarHBondContact ND1-OG1 3.46Å; H162-T166 PolarHBondContact O-N 3.17Å; H162-T166 PolarHBondContact O-OG1 3.09Å
163	R	90.9	Very high	88.5	Confident	116 Å²	116	78.2 Å²	78.2	44%	0.438	39%	0.386	S	S	.	.	H	α-helix	trans	-65.5	-40	-179.2	-55.3	174.1	64.2	-161	-2.2	111.3	D161 V165 T166 L167 E326	D161-R163 PolarHBondContact O-N 3.49Å; D161-R163 WeakPolarHBondContact OD1-CA 3.43Å; D161-R163 VanDerWaalsContact OD1-CB 3.27Å; D161-R163 WeakPolarHBondContact OD1-CB 3.41Å; D161-R163 PolarHBondContact OD1-N 2.93Å; R163-V165 VanDerWaalsContact C-N 3.31Å; R163-V165 PolarHBondContact O-N 3.17Å; R163-T166 PolarHBondContact O-N 3.39Å; R163-L167 WeakPolarHBondContact O-CB 3.42Å; R163-L167 PolarHBondContact O-N 3.16Å; R163-E326 IonicContact CZ-OE1 3.23Å; R163-E326 VanDerWaalsContact CZ-OE1 3.23Å; R163-E326 IonicContact NH1-OE1 2.77Å; R163-E326 PolarHBondContact NH1-OE1 2.88Å; R163-E326 IonicContact NH2-OE1 2.77Å; R163-E326 PolarHBondContact NH2-OE1 3.19Å
164	Y	93.6	Very high	90.3	Very high	23 Å²	23	70.3 Å²	70.3	9%	0.09	35%	0.351	C	S	.	.	H	α-helix	trans	-59.2	-42.5	172.3	166.5	-103.8	0	0	0	112.1	R130 V133 M158 P159 L160 D161 H162 K168	R130-Y164 WeakPolarHBondContact CB-OH 2.97Å; V133-Y164 HydrophobicContact CB-CE2 4.45Å; V133-Y164 HydrophobicContact CG1-CD2 3.98Å; V133-Y164 HydrophobicContact CG1-CE2 3.95Å; M158-Y164 HydrophobicContact CG-CD2 4.36Å; M158-Y164 HydrophobicContact SD-CD2 3.34Å; M158-Y164 WeakPolarHBondContact SD-CD2 3.49Å; M158-Y164 HydrophobicContact SD-CE2 3.96Å; M158-Y164 HydrophobicContact SD-CG 4.28Å; P159-Y164 WeakPolarHBondContact O-CB 3.33Å; L160-Y164 HydrophobicContact CD2-CD1 3.87Å; L160-Y164 HydrophobicContact CD2-CD2 4.31Å; L160-Y164 HydrophobicContact CD2-CE1 3.92Å; L160-Y164 HydrophobicContact CD2-CE2 4.31Å; L160-Y164 HydrophobicContact CD2-CG 4.06Å; D161-Y164 PolarHBondContact O-N 3.49Å; D161-Y164 PolarHBondContact OD1-N 3.29Å; D161-Y164 VanDerWaalsContact OD1-N 3.07Å; H162-Y164 PolarHBondContact O-N 2.96Å; Y164-K168 VanDerWaalsContact O-CB 3.28Å; Y164-K168 WeakPolarHBondContact O-CB 3.25Å; Y164-K168 PolarHBondContact O-N 2.97Å
165	V	94.6	Very high	91.9	Very high	72 Å²	72	59.7 Å²	59.7	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-45.3	179.1	179.6	0	0	0	0	110.8	D161 H162 R163 K168 N169	D161-V165 PolarHBondContact O-N 2.57Å; H162-V165 PolarHBondContact O-N 3.24Å; H162-V165 VanDerWaalsContact O-N 3.12Å; R163-V165 VanDerWaalsContact C-N 3.31Å; R163-V165 PolarHBondContact O-N 3.17Å; V165-K168 PolarHBondContact O-N 3.2Å; V165-N169 VanDerWaalsContact O-CG 3.32Å; V165-N169 PolarHBondContact O-N 3.08Å; V165-N169 PolarHBondContact O-ND2 2.75Å
166	T	95.8	Very high	92.8	Very high	45 Å²	45	65.3 Å²	65.3	28%	0.276	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-52.2	174.9	-57.1	0	0	0	0	111.3	H162 R163 K168 N169 E170	H162-T166 PolarHBondContact CE1-OG1 2.95Å; H162-T166 PolarHBondContact ND1-OG1 3.46Å; H162-T166 PolarHBondContact O-N 3.17Å; H162-T166 PolarHBondContact O-OG1 3.09Å; R163-T166 PolarHBondContact O-N 3.39Å; T166-K168 VanDerWaalsContact C-N 3.3Å; T166-K168 PolarHBondContact O-N 3.05Å; T166-N169 WeakPolarHBondContact O-CB 2.9Å; T166-N169 PolarHBondContact O-N 3.02Å; T166-E170 HydrophobicContact CG2-CG 4.45Å; T166-E170 WeakPolarHBondContact O-CG 3.2Å; T166-E170 PolarHBondContact O-N 3.22Å
167	L	95.3	Very high	93.5	Very high	42 Å²	42	64.7 Å²	64.7	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-43.1	179.6	177.3	60.1	0	0	0	111.9	H110 M113 V133 R163 N169 E170 V171	H110-L167 WeakPolarHBondContact NE2-CD1 3.45Å; M113-L167 HydrophobicContact CE-CD1 4.13Å; V133-L167 HydrophobicContact CG1-CD2 3.74Å; V133-L167 HydrophobicContact CG1-CG 4.34Å; R163-L167 WeakPolarHBondContact O-CB 3.42Å; R163-L167 PolarHBondContact O-N 3.16Å; L167-N169 VanDerWaalsContact C-N 3.31Å; L167-N169 PolarHBondContact O-N 3.39Å; L167-E170 PolarHBondContact O-N 2.85Å; L167-V171 HydrophobicContact CD1-CG2 4.39Å; L167-V171 WeakPolarHBondContact O-CG2 3.25Å; L167-V171 PolarHBondContact O-N 3.06Å
168	K	95.8	Very high	94.2	Very high	74 Å²	74	59.2 Å²	59.2	32%	0.322	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-43.7	175.7	-179.2	-169.6	167.1	-161.6	0	111.1	I129 Y164 V165 T166 V171 I172	I129-K168 HydrophobicContact CD1-CG 3.89Å; I129-K168 HydrophobicContact CG1-CG 4.31Å; I129-K168 HydrophobicContact CG2-CD 4.26Å; I129-K168 HydrophobicContact CG2-CG 4.11Å; Y164-K168 VanDerWaalsContact O-CB 3.28Å; Y164-K168 WeakPolarHBondContact O-CB 3.25Å; Y164-K168 PolarHBondContact O-N 2.97Å; V165-K168 PolarHBondContact O-N 3.2Å; T166-K168 VanDerWaalsContact C-N 3.3Å; T166-K168 PolarHBondContact O-N 3.05Å; K168-V171 PolarHBondContact O-N 3.43Å; K168-I172 HydrophobicContact CG-CD1 4.31Å; K168-I172 WeakPolarHBondContact O-CG1 3.31Å; K168-I172 PolarHBondContact O-N 3.17Å; K168-I172 VanDerWaalsContact O-N 3.15Å
169	N	96.7	Very high	94.8	Very high	75 Å²	75	59.6 Å²	59.6	40%	0.401	29%	0.287	S	S	.	.	H	α-helix	trans	-65.9	-40	178	-70.2	-19.7	0	0	0	111.5	V165 T166 L167 V171 I172 K173	V165-N169 VanDerWaalsContact O-CG 3.32Å; V165-N169 PolarHBondContact O-N 3.08Å; V165-N169 PolarHBondContact O-ND2 2.75Å; T166-N169 WeakPolarHBondContact O-CB 2.9Å; T166-N169 PolarHBondContact O-N 3.02Å; L167-N169 VanDerWaalsContact C-N 3.31Å; L167-N169 PolarHBondContact O-N 3.39Å; N169-V171 PolarHBondContact O-N 3.24Å; N169-I172 WeakPolarHBondContact O-CB 3.32Å; N169-I172 PolarHBondContact O-N 3.38Å; N169-I172 VanDerWaalsContact O-N 3.15Å; N169-K173 WeakPolarHBondContact O-CG 3.48Å; N169-K173 PolarHBondContact O-N 3.41Å
170	E	96.8	Very high	95.2	Very high	29 Å²	29	63.1 Å²	63.1	14%	0.136	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-38.5	176.2	-71.8	-50.1	126	0	0	112.9	T166 L167 I172 K173 A174 R177	T166-E170 HydrophobicContact CG2-CG 4.45Å; T166-E170 WeakPolarHBondContact O-CG 3.2Å; T166-E170 PolarHBondContact O-N 3.22Å; L167-E170 PolarHBondContact O-N 2.85Å; E170-I172 VanDerWaalsContact C-N 3.34Å; E170-I172 PolarHBondContact O-N 2.97Å; E170-K173 PolarHBondContact O-N 3.4Å; E170-K173 IonicContact OE1-NZ 2.79Å; E170-K173 PolarHBondContact OE1-NZ 3.21Å; E170-A174 VanDerWaalsContact O-CB 3.26Å; E170-A174 WeakPolarHBondContact O-CB 3.28Å; E170-A174 PolarHBondContact O-N 3.36Å; E170-R177 IonicContact OE2-NH2 3.7Å
171	V	97.3	Very high	95.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-39.1	173.1	173.7	0	0	0	0	111.3	M113 I129 V133 L167 K168 N169 A174 E175	M113-V171 HydrophobicContact CB-CG1 4.05Å; M113-V171 HydrophobicContact CB-CG2 3.83Å; M113-V171 HydrophobicContact CE-CG2 4.46Å; M113-V171 HydrophobicContact CG-CG2 4.45Å; M113-V171 HydrophobicContact SD-CG2 3.86Å; I129-V171 HydrophobicContact CD1-CB 4.13Å; I129-V171 HydrophobicContact CD1-CG1 3.88Å; I129-V171 HydrophobicContact CG1-CG1 4.2Å; V133-V171 HydrophobicContact CG2-CG2 4.42Å; L167-V171 HydrophobicContact CD1-CG2 4.39Å; L167-V171 WeakPolarHBondContact O-CG2 3.25Å; L167-V171 PolarHBondContact O-N 3.06Å; K168-V171 PolarHBondContact O-N 3.43Å; N169-V171 PolarHBondContact O-N 3.24Å; V171-A174 PolarHBondContact O-N 2.95Å; V171-E175 PolarHBondContact O-N 3.4Å
172	I	97.1	Very high	95.5	Very high	42 Å²	42	58.1 Å²	58.1	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-42.2	176	-66	166.3	0	0	0	110.9	I129 K168 N169 E170 E175 R176	I129-I172 HydrophobicContact CD1-CD1 4.03Å; I129-I172 HydrophobicContact CD1-CG1 3.47Å; I129-I172 VanDerWaalsContact CD1-CG1 3.47Å; K168-I172 HydrophobicContact CG-CD1 4.31Å; K168-I172 WeakPolarHBondContact O-CG1 3.31Å; K168-I172 PolarHBondContact O-N 3.17Å; K168-I172 VanDerWaalsContact O-N 3.15Å; N169-I172 WeakPolarHBondContact O-CB 3.32Å; N169-I172 PolarHBondContact O-N 3.38Å; N169-I172 VanDerWaalsContact O-N 3.15Å; E170-I172 VanDerWaalsContact C-N 3.34Å; E170-I172 PolarHBondContact O-N 2.97Å; I172-E175 PolarHBondContact O-N 2.93Å; I172-R176 WeakPolarHBondContact O-CG 3.22Å; I172-R176 PolarHBondContact O-N 3.4Å; I172-R176 VanDerWaalsContact O-N 3.16Å
173	K	97.2	Very high	95.4	Very high	56 Å²	56	53.9 Å²	53.9	24%	0.243	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-45.2	175.3	-71.6	177.7	175.6	-166.1	0	111.5	N169 E170 E175 R176 R177 E318	N169-K173 WeakPolarHBondContact O-CG 3.48Å; N169-K173 PolarHBondContact O-N 3.41Å; E170-K173 PolarHBondContact O-N 3.4Å; E170-K173 IonicContact OE1-NZ 2.79Å; E170-K173 PolarHBondContact OE1-NZ 3.21Å; K173-E175 VanDerWaalsContact C-N 3.3Å; K173-E175 PolarHBondContact O-N 3.27Å; K173-R176 PolarHBondContact O-N 3.22Å; K173-R176 VanDerWaalsContact O-N 3.16Å; K173-R177 WeakPolarHBondContact O-CG 3.07Å; K173-R177 PolarHBondContact O-N 3.42Å; K173-E318 VanDerWaalsContact CD-OE1 3.3Å; K173-E318 WeakPolarHBondContact CD-OE1 3.25Å; K173-E318 WeakPolarHBondContact CE-OE1 3.46Å; K173-E318 IonicContact NZ-OE1 2.59Å; K173-E318 PolarHBondContact NZ-OE1 3.04Å
174	A	97.4	Very high	95.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-40.8	175.9	0	0	0	0	0	111.8	H110 A114 E170 V171 R176 R177 V178	H110-A174 HydrophobicContact CB-CB 4.22Å; A114-A174 HydrophobicContact CB-CB 3.8Å; E170-A174 VanDerWaalsContact O-CB 3.26Å; E170-A174 WeakPolarHBondContact O-CB 3.28Å; E170-A174 PolarHBondContact O-N 3.36Å; V171-A174 PolarHBondContact O-N 2.95Å; A174-R176 PolarHBondContact O-N 3.07Å; A174-R177 WeakPolarHBondContact O-CB 3.38Å; A174-R177 PolarHBondContact O-N 3.38Å; A174-V178 WeakPolarHBondContact O-CG2 3.38Å; A174-V178 PolarHBondContact O-N 3.49Å
175	E	97.2	Very high	95.3	Very high	17 Å²	17	56.8 Å²	56.8	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-58.5	-47.8	173.2	168.6	174.3	-113.3	0	0	112.4	A114 Y117 K121 V171 I172 K173 R177 V178 L179	A114-E175 HydrophobicContact CB-CB 4.09Å; Y117-E175 VanDerWaalsContact CD1-OE1 3.26Å; Y117-E175 WeakPolarHBondContact CD1-OE1 3.32Å; Y117-E175 WeakPolarHBondContact CE1-OE1 3.37Å; Y117-E175 WeakPolarHBondContact CE1-OE2 3.49Å; K121-E175 WeakPolarHBondContact CE-OE1 3.4Å; K121-E175 IonicContact NZ-OE1 3.17Å; K121-E175 PolarHBondContact NZ-OE1 3.49Å; K121-E175 IonicContact NZ-OE2 3.41Å; K121-E175 PolarHBondContact NZ-OE2 2.94Å; K121-E175 VanDerWaalsContact NZ-OE2 3.17Å; V171-E175 PolarHBondContact O-N 3.4Å; I172-E175 PolarHBondContact O-N 2.93Å; K173-E175 VanDerWaalsContact C-N 3.3Å; K173-E175 PolarHBondContact O-N 3.27Å; E175-R177 VanDerWaalsContact C-N 3.3Å; E175-R177 PolarHBondContact O-N 3.26Å; E175-V178 PolarHBondContact O-N 3.2Å; E175-L179 HydrophobicContact CG-CD1 4.25Å; E175-L179 PolarHBondContact O-N 3.03Å
176	R	97.2	Very high	95.2	Very high	161 Å²	161	54.8 Å²	54.8	61%	0.608	27%	0.273	S	S	*	.	H	α-helix	trans	-61.8	-40.5	177.7	-65.4	179.1	-155.8	159	3.1	111.5	I172 K173 A174 L179 K180	I172-R176 WeakPolarHBondContact O-CG 3.22Å; I172-R176 PolarHBondContact O-N 3.4Å; I172-R176 VanDerWaalsContact O-N 3.16Å; K173-R176 PolarHBondContact O-N 3.22Å; K173-R176 VanDerWaalsContact O-N 3.16Å; A174-R176 PolarHBondContact O-N 3.07Å; R176-L179 PolarHBondContact O-N 2.9Å; R176-K180 WeakPolarHBondContact O-CB 3.36Å; R176-K180 PolarHBondContact O-N 3.07Å
177	R	96.7	Very high	94.9	Very high	52 Å²	52	57 Å²	57	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-48.3	174.7	-73.1	-172.2	-80.1	-171.9	-8.1	110.8	F97 E170 K173 A174 E175 L179 K180 E181 D319	F97-R177 HydrophobicContact CE2-CB 4.37Å; E170-R177 IonicContact OE2-NH2 3.7Å; K173-R177 WeakPolarHBondContact O-CG 3.07Å; K173-R177 PolarHBondContact O-N 3.42Å; A174-R177 WeakPolarHBondContact O-CB 3.38Å; A174-R177 PolarHBondContact O-N 3.38Å; E175-R177 VanDerWaalsContact C-N 3.3Å; E175-R177 PolarHBondContact O-N 3.26Å; R177-L179 PolarHBondContact O-N 3.14Å; R177-K180 PolarHBondContact O-N 2.8Å; R177-E181 WeakPolarHBondContact O-CB 3.42Å; R177-E181 VanDerWaalsContact O-CG 3.24Å; R177-E181 WeakPolarHBondContact O-CG 3.44Å; R177-E181 PolarHBondContact O-N 3.11Å; R177-D319 IonicContact NH1-OD2 3.44Å
178	V	97.1	Very high	94.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.9	-46.9	177.2	172.5	0	0	0	0	111.3	F97 T111 L118 A174 E175 L182	F97-V178 HydrophobicContact CB-CG2 4.49Å; F97-V178 HydrophobicContact CD2-CB 4.3Å; F97-V178 HydrophobicContact CD2-CG2 3.78Å; F97-V178 HydrophobicContact CE2-CG2 4.13Å; F97-V178 HydrophobicContact CG-CG2 4.08Å; T111-V178 HydrophobicContact CG2-CG2 4.08Å; L118-V178 HydrophobicContact CD2-CG1 3.96Å; A174-V178 WeakPolarHBondContact O-CG2 3.38Å; A174-V178 PolarHBondContact O-N 3.49Å; E175-V178 PolarHBondContact O-N 3.2Å; V178-L182 HydrophobicContact CG1-CD1 3.81Å; V178-L182 HydrophobicContact CG1-CG 4.43Å; V178-L182 WeakPolarHBondContact O-CB 3.2Å; V178-L182 VanDerWaalsContact O-CG 3.25Å; V178-L182 WeakPolarHBondContact O-CG 3.39Å; V178-L182 PolarHBondContact O-N 3.26Å; V178-L182 VanDerWaalsContact O-N 3.07Å
179	L	96.6	Very high	94.6	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-44.2	179.2	-73.6	171.7	0	0	0	113	L118 E175 R176 R177 G183 F184 V186	L118-L179 HydrophobicContact CD1-CD1 4.37Å; L118-L179 HydrophobicContact CD1-CD2 3.96Å; L118-L179 HydrophobicContact CD1-CG 4.35Å; L118-L179 HydrophobicContact CD2-CD2 3.76Å; L118-L179 HydrophobicContact CD2-CG 4Å; E175-L179 HydrophobicContact CG-CD1 4.25Å; E175-L179 PolarHBondContact O-N 3.03Å; R176-L179 PolarHBondContact O-N 2.9Å; R177-L179 PolarHBondContact O-N 3.14Å; L179-G183 PolarHBondContact O-N 2.93Å; L179-F184 HydrophobicContact CB-CD1 4.28Å; L179-F184 HydrophobicContact CB-CE1 4Å; L179-F184 HydrophobicContact CB-CZ 4.37Å; L179-F184 HydrophobicContact CD1-CE1 4.32Å; L179-F184 HydrophobicContact CD2-CD1 4.12Å; L179-F184 HydrophobicContact CD2-CE1 4.43Å; L179-F184 HydrophobicContact CG-CE1 4.5Å; L179-F184 PolarHBondContact O-N 3.18Å; L179-V186 HydrophobicContact CD2-CG1 3.81Å
180	K	95.2	Very high	94.3	Very high	146 Å²	146	53.7 Å²	53.7	64%	0.635	26%	0.261	S	S	*	.	H	α-helix	trans	-61.6	-47.3	178.7	-175	-177.3	178.2	-175.4	0	111.1	R176 R177 G183	R176-K180 WeakPolarHBondContact O-CB 3.36Å; R176-K180 PolarHBondContact O-N 3.07Å; R177-K180 PolarHBondContact O-N 2.8Å; K180-G183 PolarHBondContact O-N 3.06Å
181	E	93.3	Very high	94.2	Very high	64 Å²	64	52.3 Å²	52.3	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-72.1	-30.2	-176.3	-67.1	-56.6	154.9	0	0	113.7	F97 K101 R177 G183	F97-E181 HydrophobicContact CD2-CB 4.17Å; F97-E181 HydrophobicContact CD2-CG 4.42Å; F97-E181 HydrophobicContact CE2-CB 4.24Å; F97-E181 HydrophobicContact CE2-CG 4Å; K101-E181 VanDerWaalsContact CE-CG 3.43Å; K101-E181 WeakPolarHBondContact CE-OE1 3.36Å; K101-E181 WeakPolarHBondContact CE-OE2 3.42Å; K101-E181 HydrophobicContact CG-CG 4.18Å; K101-E181 IonicContact NZ-OE1 3.94Å; K101-E181 PolarHBondContact NZ-OE1 3.22Å; K101-E181 IonicContact NZ-OE2 3.98Å; K101-E181 PolarHBondContact NZ-OE2 3Å; K101-E181 VanDerWaalsContact NZ-OE2 3.14Å; R177-E181 WeakPolarHBondContact O-CB 3.42Å; R177-E181 VanDerWaalsContact O-CG 3.24Å; R177-E181 WeakPolarHBondContact O-CG 3.44Å; R177-E181 PolarHBondContact O-N 3.11Å; E181-G183 VanDerWaalsContact C-N 3.25Å
182	L	92	Very high	94	Very high	23 Å²	23	53 Å²	53	12%	0.12	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	1	174.5	-60.7	-177.9	0	0	0	112.8	L93 R96 V178 F184 C185	L93-L182 HydrophobicContact CD2-CD1 3.63Å; R96-L182 HydrophobicContact CB-CD1 4.49Å; R96-L182 HydrophobicContact CB-CD2 3.51Å; V178-L182 HydrophobicContact CG1-CD1 3.81Å; V178-L182 HydrophobicContact CG1-CG 4.43Å; V178-L182 WeakPolarHBondContact O-CB 3.2Å; V178-L182 VanDerWaalsContact O-CG 3.25Å; V178-L182 WeakPolarHBondContact O-CG 3.39Å; V178-L182 PolarHBondContact O-N 3.26Å; V178-L182 VanDerWaalsContact O-N 3.07Å; L182-F184 PolarHBondContact O-N 3.36Å; L182-C185 WeakPolarHBondContact O-CB 3.11Å; L182-C185 PolarHBondContact O-N 3.16Å
183	G	90.2	Very high	93.9	Very high	59 Å²	59	59.2 Å²	59.2	61%	0.608	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	33.2	-176.8	0	0	0	0	0	112.8	L179 K180 E181 C185	L179-G183 PolarHBondContact O-N 2.93Å; K180-G183 PolarHBondContact O-N 3.06Å; E181-G183 VanDerWaalsContact C-N 3.25Å; G183-C185 PolarHBondContact O-N 3.31Å; G183-C185 VanDerWaalsContact O-N 3.07Å
184	F	90.9	Very high	93.8	Very high	147 Å²	147	58.5 Å²	58.5	65%	0.645	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	12	-171.4	-60.3	-95.6	0	0	0	115.1	L179 L182 V186	L179-F184 HydrophobicContact CB-CD1 4.28Å; L179-F184 HydrophobicContact CB-CE1 4Å; L179-F184 HydrophobicContact CB-CZ 4.37Å; L179-F184 HydrophobicContact CD1-CE1 4.32Å; L179-F184 HydrophobicContact CD2-CD1 4.12Å; L179-F184 HydrophobicContact CD2-CE1 4.43Å; L179-F184 HydrophobicContact CG-CE1 4.5Å; L179-F184 PolarHBondContact O-N 3.18Å; L182-F184 PolarHBondContact O-N 3.36Å; F184-V186 VanDerWaalsContact C-N 3.27Å; F184-V186 PolarHBondContact O-N 3.36Å
185	C	90.5	Very high	93.7	Very high	54 Å²	54	58.5 Å²	58.5	37%	0.365	28%	0.282	S	S	.	.			trans	-77.8	75.7	171.9	-171.3	0	0	0	0	110.6	R96 L182 G183	R96-C185 PolarHBondContact NH1-O 2.89Å; L182-C185 WeakPolarHBondContact O-CB 3.11Å; L182-C185 PolarHBondContact O-N 3.16Å; G183-C185 PolarHBondContact O-N 3.31Å; G183-C185 VanDerWaalsContact O-N 3.07Å
186	V	92.1	Very high	93.6	Very high	29 Å²	29	63.3 Å²	63.3	18%	0.176	30%	0.3	C	S	.	.			trans	-101.5	-0.7	-177.5	-59.3	0	0	0	0	113.8	L93 L118 I122 L179 F184	L93-V186 HydrophobicContact CD2-CB 4.07Å; L93-V186 HydrophobicContact CD2-CG1 4.13Å; L118-V186 HydrophobicContact CD2-CG1 4.49Å; I122-V186 HydrophobicContact CD1-CB 3.61Å; I122-V186 HydrophobicContact CD1-CG1 4.25Å; I122-V186 HydrophobicContact CD1-CG2 3.74Å; I122-V186 HydrophobicContact CG1-CB 4.44Å; I122-V186 HydrophobicContact CG1-CG2 4.01Å; L179-V186 HydrophobicContact CD2-CG1 3.81Å; F184-V186 VanDerWaalsContact C-N 3.27Å; F184-V186 PolarHBondContact O-N 3.36Å
187	H	91	Very high	93.5	Very high	91 Å²	91	59.4 Å²	59.4	42%	0.421	29%	0.294	S	S	.	.			trans	-68.6	135.3	176.3	-175.9	70	0	0	0	111.1	L37 R96	L37-H187 PolarHBondContact O-CD2 3.42Å; R96-H187 PolarHBondContact NH1-O 3.08Å; R96-H187 VanDerWaalsContact NH1-O 3.11Å
188	I	91.9	Very high	93.5	Very high	13 Å²	13	57.6 Å²	57.6	7%	0.067	29%	0.287	C	S	.	.			trans	-137.7	118	-177.3	-60.6	159.5	0	0	0	109.4	A89 V92 L93 H190	A89-I188 HydrophobicContact CB-CD1 3.91Å; A89-I188 WeakPolarHBondContact O-CD1 3.42Å; V92-I188 HydrophobicContact CB-CD1 3.85Å; V92-I188 HydrophobicContact CB-CG1 4.41Å; V92-I188 HydrophobicContact CB-CG2 4.3Å; V92-I188 HydrophobicContact CG1-CD1 3.84Å; V92-I188 HydrophobicContact CG1-CG1 3.93Å; V92-I188 HydrophobicContact CG1-CG2 4.06Å; V92-I188 HydrophobicContact CG2-CG2 4.26Å; L93-I188 HydrophobicContact CD2-CD1 4.02Å; L93-I188 HydrophobicContact CG-CD1 3.89Å; I188-H190 VanDerWaalsContact CG2-CE1 3.43Å; I188-H190 WeakPolarHBondContact CG2-CE1 3.43Å
189	K	92.3	Very high	93.5	Very high	77 Å²	77	57.6 Å²	57.6	34%	0.335	29%	0.287	S	S	.	.			trans	-84.1	118.8	168.1	-70.1	176.7	173.3	166.6	0	109.3	L37 N39 P232	L37-K189 WeakPolarHBondContact O-CD 3.47Å; L37-K189 WeakPolarHBondContact O-CE 3.36Å; L37-K189 PolarHBondContact O-NZ 3.25Å; L37-K189 VanDerWaalsContact O-NZ 3.15Å; N39-K189 PolarHBondContact ND2-O 3.14Å; N39-K189 PolarHBondContact OD1-N 3.33Å; K189-P232 HydrophobicContact CB-CG 4.17Å
190	H	91.3	Very high	93.4	Very high	32 Å²	32	62.2 Å²	62.2	15%	0.148	31%	0.306	C	S	.	.			trans	-93.5	134.7	179.7	-72.4	-63	0	0	0	112.4	A88 A89 I188 H192	A88-H190 VanDerWaalsContact C-CE1 3.5Å; A88-H190 WeakPolarHBondContact CB-CE1 3.4Å; A89-H190 PolarHBondContact N-CE1 2.67Å; I188-H190 VanDerWaalsContact CG2-CE1 3.43Å; I188-H190 WeakPolarHBondContact CG2-CE1 3.43Å; H190-H192 PolarHBondContact O-N 3.47Å
191	P	93.6	Very high	93.4	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.9	-177.8	30	-37.1	0	0	0	114.1	K193 L194 I195 M218 F227 P232 I235 A236	P191-K193 VanDerWaalsContact C-N 3.32Å; P191-K193 PolarHBondContact O-N 3.41Å; P191-L194 WeakPolarHBondContact O-CB 3.35Å; P191-L194 PolarHBondContact O-N 2.92Å; P191-I195 PolarHBondContact O-N 3.26Å; P191-M218 HydrophobicContact CB-CG 4.32Å; P191-M218 HydrophobicContact CG-CG 3.58Å; P191-M218 HydrophobicContact CG-SD 4.15Å; P191-F227 HydrophobicContact CG-CE1 4.03Å; P191-F227 HydrophobicContact CG-CZ 3.77Å; P191-P232 HydrophobicContact CB-CB 4.2Å; P191-P232 WeakPolarHBondContact CB-O 3.5Å; P191-I235 HydrophobicContact CB-CG2 4.4Å; P191-I235 HydrophobicContact CG-CG2 4.09Å; P191-A236 HydrophobicContact CB-CB 4.03Å
192	H	93.7	Very high	93.4	Very high	14 Å²	14	56.4 Å²	56.4	7%	0.065	29%	0.292	C	S	.	.	H	α-helix	trans	-50.3	-46.9	-176.7	-61	66.7	0	0	0	113.5	H190 L194 W215 M218 N219	H190-H192 PolarHBondContact O-N 3.47Å; H192-L194 VanDerWaalsContact C-N 3.34Å; H192-W215 HydrophobicContact CB-CH2 3.71Å; H192-W215 HydrophobicContact CB-CZ2 4.02Å; H192-W215 HydrophobicContact CB-CZ3 4.05Å; H192-W215 AromaticContact CD2-CE2 3.7Å; H192-W215 AromaticContact CD2-CZ2 3.54Å; H192-W215 AromaticContact CD2-NE1 3.97Å; H192-W215 WeakPolarHBondContact O-CZ3 3.37Å; H192-M218 HydrophobicContact CB-CE 4.15Å; H192-M218 WeakPolarHBondContact CD2-CE 3.08Å; H192-M218 PolarHBondContact CE1-SD 2.84Å; H192-M218 PolarHBondContact ND1-SD 3.06Å; H192-M218 VanDerWaalsContact ND1-SD 3.39Å; H192-M218 WeakPolarHBondContact NE2-CE 3.41Å; H192-M218 PolarHBondContact NE2-SD 2.98Å; H192-N219 PolarHBondContact NE2-OD1 3.01Å; H192-N219 VanDerWaalsContact NE2-OD1 3.09Å
193	K	94.1	Very high	93.5	Very high	174 Å²	174	62.7 Å²	62.7	76%	0.757	33%	0.325	S	S	*	.	H	α-helix	trans	-69.6	-32.4	-179.7	-68.3	-177.5	-179.9	176.5	0	112.1	P191 Y196 V197	P191-K193 VanDerWaalsContact C-N 3.32Å; P191-K193 PolarHBondContact O-N 3.41Å; K193-Y196 PolarHBondContact O-N 3.26Å; K193-V197 WeakPolarHBondContact O-CG2 3.34Å; K193-V197 PolarHBondContact O-N 3.36Å
194	L	95.6	Very high	93.7	Very high	41 Å²	41	60.5 Å²	60.5	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-38.5	179.6	-59.5	177.2	0	0	0	111.3	P191 H192 Y196 V197 Y198 P232 E233 A236	P191-L194 WeakPolarHBondContact O-CB 3.35Å; P191-L194 PolarHBondContact O-N 2.92Å; H192-L194 VanDerWaalsContact C-N 3.34Å; L194-Y196 VanDerWaalsContact C-N 3.27Å; L194-Y196 PolarHBondContact O-N 3.15Å; L194-V197 PolarHBondContact O-N 3.32Å; L194-V197 VanDerWaalsContact O-N 3.12Å; L194-Y198 HydrophobicContact CB-CE1 4.4Å; L194-Y198 HydrophobicContact CB-CE2 4Å; L194-Y198 WeakPolarHBondContact O-CB 3.33Å; L194-Y198 WeakPolarHBondContact O-CD1 3.35Å; L194-Y198 PolarHBondContact O-N 3.2Å; L194-P232 HydrophobicContact CD1-CB 4.05Å; L194-E233 HydrophobicContact CD1-CB 4.45Å; L194-E233 HydrophobicContact CD1-CG 4.06Å; L194-A236 HydrophobicContact CB-CB 3.7Å; L194-A236 HydrophobicContact CD1-CB 4.46Å
195	I	95.9	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-54.4	-45.3	175.3	-66.6	174.1	0	0	0	111.3	P191 L199 L211 A214 M218 A236 C239 V240	P191-I195 PolarHBondContact O-N 3.26Å; I195-L199 HydrophobicContact CG2-CD1 3.94Å; I195-L199 WeakPolarHBondContact O-CB 3.41Å; I195-L199 WeakPolarHBondContact O-CG 3.43Å; I195-L199 PolarHBondContact O-N 3.4Å; I195-L211 HydrophobicContact CG2-CD1 4.12Å; I195-A214 HydrophobicContact CG2-CB 3.92Å; I195-M218 HydrophobicContact CD1-CB 3.55Å; I195-M218 HydrophobicContact CD1-CE 4.31Å; I195-M218 HydrophobicContact CD1-CG 3.8Å; I195-A236 HydrophobicContact CG1-CB 3.94Å; I195-C239 HydrophobicContact CD1-CB 4.34Å; I195-V240 HydrophobicContact CB-CG2 4.5Å; I195-V240 HydrophobicContact CG1-CG2 4.42Å; I195-V240 HydrophobicContact CG2-CG2 3.99Å
196	Y	95	Very high	93.9	Very high	118 Å²	118	61.6 Å²	61.6	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-46.2	178.3	-177.3	-83.3	0	0	0	111.6	K193 L194 Y198 L199 K200 L205	K193-Y196 PolarHBondContact O-N 3.26Å; L194-Y196 VanDerWaalsContact C-N 3.27Å; L194-Y196 PolarHBondContact O-N 3.15Å; Y196-Y198 PolarHBondContact O-N 3.5Å; Y196-L199 PolarHBondContact O-N 2.96Å; Y196-K200 WeakPolarHBondContact O-CB 3.24Å; Y196-K200 PolarHBondContact O-N 3.4Å; Y196-L205 HydrophobicContact CD2-CD1 3.62Å; Y196-L205 HydrophobicContact CE1-CD2 4.09Å; Y196-L205 HydrophobicContact CE2-CD1 3.57Å; Y196-L205 HydrophobicContact CE2-CD2 3.89Å; Y196-L205 HydrophobicContact CE2-CG 4.28Å; Y196-L205 HydrophobicContact CG-CD1 4.17Å
197	V	95.7	Very high	94	Very high	80 Å²	80	63.1 Å²	63.1	49%	0.485	31%	0.312	S	S	.	.	H	α-helix	trans	-61.8	-44.4	179.4	175.8	0	0	0	0	111.1	K193 L194 K200 A201	K193-V197 WeakPolarHBondContact O-CG2 3.34Å; K193-V197 PolarHBondContact O-N 3.36Å; L194-V197 PolarHBondContact O-N 3.32Å; L194-V197 VanDerWaalsContact O-N 3.12Å; V197-K200 WeakPolarHBondContact O-CB 3.46Å; V197-K200 PolarHBondContact O-N 3.21Å; V197-A201 PolarHBondContact O-N 3.07Å
198	Y	95.9	Very high	94.2	Very high	13 Å²	13	63.9 Å²	63.9	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-67.3	-44.8	-179.6	-60.8	-14.4	0	0	0	111.7	L194 Y196 K200 A201 L202 E233 A236 C237 F261	L194-Y198 HydrophobicContact CB-CE1 4.4Å; L194-Y198 HydrophobicContact CB-CE2 4Å; L194-Y198 WeakPolarHBondContact O-CB 3.33Å; L194-Y198 WeakPolarHBondContact O-CD1 3.35Å; L194-Y198 PolarHBondContact O-N 3.2Å; Y196-Y198 PolarHBondContact O-N 3.5Å; Y198-K200 PolarHBondContact O-N 3.49Å; Y198-A201 PolarHBondContact O-N 3Å; Y198-A201 VanDerWaalsContact O-N 3.13Å; Y198-L202 VanDerWaalsContact O-CG 3.23Å; Y198-L202 WeakPolarHBondContact O-CG 3.42Å; Y198-L202 PolarHBondContact O-N 2.97Å; Y198-E233 WeakPolarHBondContact OH-CA 3.26Å; Y198-E233 VanDerWaalsContact OH-CB 3.29Å; Y198-E233 WeakPolarHBondContact OH-CB 3.26Å; Y198-A236 HydrophobicContact CD2-CB 3.93Å; Y198-A236 HydrophobicContact CE2-CB 3.55Å; Y198-C237 VanDerWaalsContact CE2-SG 3.59Å; Y198-F261 AromaticContact CD1-CD1 3.5Å; Y198-F261 HydrophobicContact CD1-CD1 3.5Å; Y198-F261 AromaticContact CD1-CD2 3.81Å; Y198-F261 HydrophobicContact CD1-CD2 3.81Å; Y198-F261 AromaticContact CD1-CE1 3.45Å; Y198-F261 HydrophobicContact CD1-CE1 3.45Å; Y198-F261 VanDerWaalsContact CD1-CE1 3.45Å; Y198-F261 AromaticContact CD1-CE2 3.75Å; Y198-F261 HydrophobicContact CD1-CE2 3.75Å; Y198-F261 AromaticContact CD1-CG 3.69Å; Y198-F261 HydrophobicContact CD1-CG 3.69Å; Y198-F261 AromaticContact CD1-CZ 3.58Å; Y198-F261 HydrophobicContact CD1-CZ 3.58Å; Y198-F261 HydrophobicContact CD2-CD2 4.1Å; Y198-F261 HydrophobicContact CD2-CE2 4.37Å; Y198-F261 HydrophobicContact CD2-CG 4.43Å; Y198-F261 HydrophobicContact CE1-CB 3.96Å; Y198-F261 AromaticContact CE1-CD1 3.36Å; Y198-F261 HydrophobicContact CE1-CD1 3.36Å; Y198-F261 HydrophobicContact CE1-CD2 4.07Å; Y198-F261 AromaticContact CE1-CE1 3.81Å; Y198-F261 HydrophobicContact CE1-CE1 3.81Å; Y198-F261 HydrophobicContact CE1-CE2 4.43Å; Y198-F261 AromaticContact CE1-CG 3.52Å; Y198-F261 HydrophobicContact CE1-CG 3.52Å; Y198-F261 HydrophobicContact CE1-CZ 4.32Å; Y198-F261 HydrophobicContact CE2-CB 4.31Å; Y198-F261 HydrophobicContact CE2-CD2 4.32Å; Y198-F261 HydrophobicContact CE2-CG 4.27Å; Y198-F261 HydrophobicContact CG-CD1 4.37Å; Y198-F261 AromaticContact CG-CD2 3.84Å; Y198-F261 HydrophobicContact CG-CD2 3.84Å; Y198-F261 HydrophobicContact CG-CE1 4.28Å; Y198-F261 AromaticContact CG-CE2 3.72Å; Y198-F261 HydrophobicContact CG-CE2 3.72Å; Y198-F261 HydrophobicContact CG-CG 4.17Å; Y198-F261 AromaticContact CG-CZ 3.97Å; Y198-F261 HydrophobicContact CG-CZ 3.97Å; Y198-F261 AromaticContact CZ-CG 3.82Å
199	L	96	Very high	94.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-32.6	176	-72	174.1	0	0	0	112.4	I195 Y196 L202 D203 A204 L205 L210 L211 V240	I195-L199 HydrophobicContact CG2-CD1 3.94Å; I195-L199 WeakPolarHBondContact O-CB 3.41Å; I195-L199 WeakPolarHBondContact O-CG 3.43Å; I195-L199 PolarHBondContact O-N 3.4Å; Y196-L199 PolarHBondContact O-N 2.96Å; L199-L202 PolarHBondContact O-N 3.26Å; L199-D203 PolarHBondContact O-N 2.73Å; L199-A204 HydrophobicContact CD2-CB 4.06Å; L199-A204 CarbonylContact O-C 3.55Å; L199-A204 PolarHBondContact O-N 3.08Å; L199-L205 HydrophobicContact CB-CB 4.49Å; L199-L205 HydrophobicContact CB-CD1 4.3Å; L199-L205 PolarHBondContact O-N 3.02Å; L199-L205 VanDerWaalsContact O-N 3.1Å; L199-L210 HydrophobicContact CD2-CD2 3.6Å; L199-L210 HydrophobicContact CD2-CG 3.86Å; L199-L211 HydrophobicContact CD1-CB 3.86Å; L199-L211 HydrophobicContact CD1-CD1 3.64Å; L199-L211 HydrophobicContact CD1-CG 4.36Å; L199-V240 HydrophobicContact CD2-CG1 3.77Å; L199-V240 HydrophobicContact CD2-CG2 4.33Å; L199-V240 HydrophobicContact CG-CG1 4.5Å; L199-V240 HydrophobicContact CG-CG2 4.23Å
200	K	95.2	Very high	94.7	Very high	131 Å²	131	62 Å²	62	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-66	-45.1	171.9	-170.9	177	178.7	-179.4	0	111.8	Y196 V197 Y198 L202 D203 L205	Y196-K200 WeakPolarHBondContact O-CB 3.24Å; Y196-K200 PolarHBondContact O-N 3.4Å; V197-K200 WeakPolarHBondContact O-CB 3.46Å; V197-K200 PolarHBondContact O-N 3.21Å; Y198-K200 PolarHBondContact O-N 3.49Å; K200-L202 PolarHBondContact O-N 3.02Å; K200-D203 PolarHBondContact O-N 3.28Å; K200-L205 HydrophobicContact CB-CB 4.46Å; K200-L205 HydrophobicContact CB-CD2 4.13Å; K200-L205 HydrophobicContact CG-CD2 4.25Å
201	A	94.6	Very high	95	Very high	58 Å²	58	62.4 Å²	62.4	48%	0.479	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-22.1	178.3	0	0	0	0	0	113.6	V197 Y198 F261	V197-A201 PolarHBondContact O-N 3.07Å; Y198-A201 PolarHBondContact O-N 3Å; Y198-A201 VanDerWaalsContact O-N 3.13Å; A201-F261 HydrophobicContact CB-CE1 4.32Å; A201-F261 HydrophobicContact CB-CZ 3.87Å
202	L	94.4	Very high	95.1	Very high	30 Å²	30	67.6 Å²	67.6	16%	0.157	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	8.1	176	-62.9	170.1	0	0	0	113.5	Y198 L199 K200 A204 V240 L251 W257	Y198-L202 VanDerWaalsContact O-CG 3.23Å; Y198-L202 WeakPolarHBondContact O-CG 3.42Å; Y198-L202 PolarHBondContact O-N 2.97Å; L199-L202 PolarHBondContact O-N 3.26Å; K200-L202 PolarHBondContact O-N 3.02Å; L202-A204 HydrophobicContact CB-CB 4.22Å; L202-A204 PolarHBondContact O-N 3.42Å; L202-V240 HydrophobicContact CD1-CG1 4.31Å; L202-L251 HydrophobicContact CD1-CD1 4.35Å; L202-L251 HydrophobicContact CD1-CD2 4.41Å; L202-W257 HydrophobicContact CD1-CD2 3.78Å; L202-W257 HydrophobicContact CD1-CE3 3.59Å; L202-W257 HydrophobicContact CD1-CG 4.42Å; L202-W257 HydrophobicContact CD1-CH2 4.21Å; L202-W257 HydrophobicContact CD1-CZ2 4.4Å; L202-W257 HydrophobicContact CD1-CZ3 3.81Å; L202-W257 HydrophobicContact CD2-CB 3.69Å; L202-W257 HydrophobicContact CD2-CD2 3.99Å; L202-W257 HydrophobicContact CD2-CE3 3.94Å; L202-W257 HydrophobicContact CD2-CG 3.92Å; L202-W257 HydrophobicContact CG-CE3 4.24Å
203	D	93.6	Very high	95.2	Very high	155 Å²	155	70.6 Å²	70.6	83%	0.829	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	31.2	-172.7	-66.1	-41.5	0	0	0	113.5	L199 K200	L199-D203 PolarHBondContact O-N 2.73Å; K200-D203 PolarHBondContact O-N 3.28Å
204	A	93.6	Very high	95.4	Very high	14 Å²	14	62.3 Å²	62.3	12%	0.116	33%	0.328	C	S	.	.			trans	-114.1	6.2	-175.6	0	0	0	0	0	112.8	L199 L202 E206 N207 L210	L199-A204 HydrophobicContact CD2-CB 4.06Å; L199-A204 CarbonylContact O-C 3.55Å; L199-A204 PolarHBondContact O-N 3.08Å; L202-A204 HydrophobicContact CB-CB 4.22Å; L202-A204 PolarHBondContact O-N 3.42Å; A204-E206 VanDerWaalsContact C-N 3.32Å; A204-E206 PolarHBondContact O-N 3.29Å; A204-N207 WeakPolarHBondContact O-CB 3.37Å; A204-N207 PolarHBondContact O-N 3.36Å; A204-L210 HydrophobicContact CB-CD2 4.06Å
205	L	93.4	Very high	95.4	Very high	38 Å²	38	64.5 Å²	64.5	20%	0.199	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-32.1	-177	-176.3	66.2	0	0	0	113.1	Y196 L199 K200 N207 L211	Y196-L205 HydrophobicContact CD2-CD1 3.62Å; Y196-L205 HydrophobicContact CE1-CD2 4.09Å; Y196-L205 HydrophobicContact CE2-CD1 3.57Å; Y196-L205 HydrophobicContact CE2-CD2 3.89Å; Y196-L205 HydrophobicContact CE2-CG 4.28Å; Y196-L205 HydrophobicContact CG-CD1 4.17Å; L199-L205 HydrophobicContact CB-CB 4.49Å; L199-L205 HydrophobicContact CB-CD1 4.3Å; L199-L205 PolarHBondContact O-N 3.02Å; L199-L205 VanDerWaalsContact O-N 3.1Å; K200-L205 HydrophobicContact CB-CB 4.46Å; K200-L205 HydrophobicContact CB-CD2 4.13Å; K200-L205 HydrophobicContact CG-CD2 4.25Å; L205-N207 PolarHBondContact O-N 3.46Å; L205-L211 HydrophobicContact CD1-CD2 4.35Å
206	E	93.6	Very high	95.5	Very high	186 Å²	186	66.7 Å²	66.7	87%	0.869	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.3	177	-60.5	-172.3	165.6	0	0	112.2	A204 T208	A204-E206 VanDerWaalsContact C-N 3.32Å; A204-E206 PolarHBondContact O-N 3.29Å; E206-T208 VanDerWaalsContact C-N 3.31Å; E206-T208 PolarHBondContact O-N 3.18Å
207	N	94.6	Very high	95.6	Very high	60 Å²	60	61.7 Å²	61.7	32%	0.321	33%	0.326	S	S	.	.			trans	-77.1	83.5	174.2	-166.6	-32	0	0	0	110.6	A204 L205 A209 L210 L211 I249	A204-N207 WeakPolarHBondContact O-CB 3.37Å; A204-N207 PolarHBondContact O-N 3.36Å; L205-N207 PolarHBondContact O-N 3.46Å; N207-A209 PolarHBondContact O-N 2.87Å; N207-A209 PolarHBondContact OD1-N 3.34Å; N207-L210 HydrophobicContact CB-CB 4.01Å; N207-L210 PolarHBondContact O-N 3.33Å; N207-L210 VanDerWaalsContact O-N 3.08Å; N207-L210 PolarHBondContact OD1-N 2.95Å; N207-L211 PolarHBondContact O-N 2.84Å; N207-I249 WeakPolarHBondContact ND2-CD1 3.46Å
208	T	95.2	Very high	95.6	Very high	108 Å²	108	57.9 Å²	57.9	66%	0.663	30%	0.303	S	S	*	.	H	α-helix	trans	-58.2	-31.4	179.5	58.5	0	0	0	0	112.9	E206 Q212	E206-T208 VanDerWaalsContact C-N 3.31Å; E206-T208 PolarHBondContact O-N 3.18Å; T208-Q212 VanDerWaalsContact O-CB 3.28Å; T208-Q212 WeakPolarHBondContact O-CB 3.48Å; T208-Q212 PolarHBondContact O-N 2.87Å
209	A	96.8	Very high	95.6	Very high	51 Å²	51	58.7 Å²	58.7	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.1	0	0	0	0	0	111.7	N207 K213 L247	N207-A209 PolarHBondContact O-N 2.87Å; N207-A209 PolarHBondContact OD1-N 3.34Å; A209-K213 WeakPolarHBondContact O-CB 2.95Å; A209-K213 PolarHBondContact O-N 3.29Å; A209-L247 HydrophobicContact CB-CD1 4.29Å
210	L	97.1	Very high	95.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-47.7	175.1	176.3	57.3	0	0	0	111.5	L199 A204 N207 Q212 K213 A214 G243 A244 L247 I249	L199-L210 HydrophobicContact CD2-CD2 3.6Å; L199-L210 HydrophobicContact CD2-CG 3.86Å; A204-L210 HydrophobicContact CB-CD2 4.06Å; N207-L210 HydrophobicContact CB-CB 4.01Å; N207-L210 PolarHBondContact O-N 3.33Å; N207-L210 VanDerWaalsContact O-N 3.08Å; N207-L210 PolarHBondContact OD1-N 2.95Å; L210-Q212 PolarHBondContact O-N 2.91Å; L210-K213 PolarHBondContact O-N 3.17Å; L210-A214 WeakPolarHBondContact O-CB 3.34Å; L210-A214 PolarHBondContact O-N 3.35Å; L210-G243 VanDerWaalsContact CD1-C 3.48Å; L210-A244 HydrophobicContact CD1-CB 4.01Å; L210-A244 VanDerWaalsContact CD1-N 3.27Å; L210-L247 HydrophobicContact CB-CD1 4.04Å; L210-L247 HydrophobicContact CD1-CD1 4.34Å; L210-I249 HydrophobicContact CB-CD1 3.99Å; L210-I249 HydrophobicContact CD1-CD1 4.41Å; L210-I249 HydrophobicContact CD2-CD1 4.1Å; L210-I249 HydrophobicContact CG-CD1 4.39Å
211	L	96.9	Very high	95.6	Very high	40 Å²	40	54.1 Å²	54.1	21%	0.209	29%	0.289	C	S	.	.	H	α-helix	trans	-55.2	-51.8	176.4	174.3	61.7	0	0	0	111.3	I195 L199 L205 N207 K213 A214 W215	I195-L211 HydrophobicContact CG2-CD1 4.12Å; L199-L211 HydrophobicContact CD1-CB 3.86Å; L199-L211 HydrophobicContact CD1-CD1 3.64Å; L199-L211 HydrophobicContact CD1-CG 4.36Å; L205-L211 HydrophobicContact CD1-CD2 4.35Å; N207-L211 PolarHBondContact O-N 2.84Å; L211-K213 VanDerWaalsContact C-N 3.31Å; L211-K213 PolarHBondContact O-N 2.92Å; L211-A214 PolarHBondContact O-N 2.86Å; L211-W215 WeakPolarHBondContact O-CB 3.37Å; L211-W215 PolarHBondContact O-N 3.31Å
212	Q	96.5	Very high	95.6	Very high	109 Å²	109	51.5 Å²	51.5	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-39.8	179.6	-174.8	63.1	55	0	0	111.7	T208 L210 W215 N216	T208-Q212 VanDerWaalsContact O-CB 3.28Å; T208-Q212 WeakPolarHBondContact O-CB 3.48Å; T208-Q212 PolarHBondContact O-N 2.87Å; L210-Q212 PolarHBondContact O-N 2.91Å; Q212-W215 PolarHBondContact O-N 3.49Å; Q212-N216 PolarHBondContact NE2-OD1 3.11Å; Q212-N216 WeakPolarHBondContact O-CB 3.5Å; Q212-N216 PolarHBondContact O-N 3.4Å; Q212-N216 PolarHBondContact O-ND2 2.98Å; Q212-N216 PolarHBondContact O-OD1 3.03Å
213	K	96.3	Very high	95.6	Very high	76 Å²	76	51.1 Å²	51.1	33%	0.33	26%	0.264	S	S	.	.	H	α-helix	trans	-66.2	-46.9	179.9	-167.4	76.5	179.8	-169.2	0	111.6	A209 L210 L211 W215 N216 Y217 S246 L247	A209-K213 WeakPolarHBondContact O-CB 2.95Å; A209-K213 PolarHBondContact O-N 3.29Å; L210-K213 PolarHBondContact O-N 3.17Å; L211-K213 VanDerWaalsContact C-N 3.31Å; L211-K213 PolarHBondContact O-N 2.92Å; K213-W215 VanDerWaalsContact C-N 3.34Å; K213-N216 PolarHBondContact O-N 3.34Å; K213-Y217 HydrophobicContact CD-CE2 4.14Å; K213-Y217 WeakPolarHBondContact CE-OH 3.32Å; K213-Y217 HydrophobicContact CG-CD2 4.1Å; K213-Y217 HydrophobicContact CG-CE2 3.61Å; K213-Y217 WeakPolarHBondContact O-CD2 3.36Å; K213-Y217 PolarHBondContact O-N 2.88Å; K213-S246 VanDerWaalsContact CE-OG 3.32Å; K213-S246 WeakPolarHBondContact CE-OG 3.45Å; K213-L247 HydrophobicContact CB-CD1 4.21Å
214	A	97.6	Very high	95.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-42.7	176	0	0	0	0	0	111.6	I195 L210 L211 N216 Y217 M218 V240	I195-A214 HydrophobicContact CG2-CB 3.92Å; L210-A214 WeakPolarHBondContact O-CB 3.34Å; L210-A214 PolarHBondContact O-N 3.35Å; L211-A214 PolarHBondContact O-N 2.86Å; A214-N216 VanDerWaalsContact C-N 3.35Å; A214-N216 PolarHBondContact O-N 3Å; A214-Y217 PolarHBondContact O-N 3.16Å; A214-M218 PolarHBondContact O-N 3.37Å; A214-V240 HydrophobicContact CB-CG2 4.04Å
215	W	96.5	Very high	95.6	Very high	88 Å²	88	44.9 Å²	44.9	33%	0.333	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-40.4	176.2	-164.5	-77.5	0	0	0	112.5	H192 L211 Q212 K213 M218 N219	H192-W215 HydrophobicContact CB-CH2 3.71Å; H192-W215 HydrophobicContact CB-CZ2 4.02Å; H192-W215 HydrophobicContact CB-CZ3 4.05Å; H192-W215 AromaticContact CD2-CE2 3.7Å; H192-W215 AromaticContact CD2-CZ2 3.54Å; H192-W215 AromaticContact CD2-NE1 3.97Å; H192-W215 WeakPolarHBondContact O-CZ3 3.37Å; L211-W215 WeakPolarHBondContact O-CB 3.37Å; L211-W215 PolarHBondContact O-N 3.31Å; Q212-W215 PolarHBondContact O-N 3.49Å; K213-W215 VanDerWaalsContact C-N 3.34Å; W215-M218 HydrophobicContact CD2-CE 4.11Å; W215-M218 HydrophobicContact CG-CE 4.07Å; W215-M218 WeakPolarHBondContact O-CE 3.31Å; W215-M218 PolarHBondContact O-N 2.91Å; W215-N219 VanDerWaalsContact CD1-ND2 3.31Å; W215-N219 PolarHBondContact O-N 3.22Å
216	N	96.2	Very high	95.7	Very high	46 Å²	46	43.1 Å²	43.1	25%	0.246	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-47.4	175.3	-68.7	-17.7	0	0	0	111.2	Q212 K213 A214 M218 N219 D220	Q212-N216 PolarHBondContact NE2-OD1 3.11Å; Q212-N216 WeakPolarHBondContact O-CB 3.5Å; Q212-N216 PolarHBondContact O-N 3.4Å; Q212-N216 PolarHBondContact O-ND2 2.98Å; Q212-N216 PolarHBondContact O-OD1 3.03Å; K213-N216 PolarHBondContact O-N 3.34Å; A214-N216 VanDerWaalsContact C-N 3.35Å; A214-N216 PolarHBondContact O-N 3Å; N216-M218 VanDerWaalsContact C-N 3.26Å; N216-M218 PolarHBondContact O-N 3.37Å; N216-N219 PolarHBondContact O-N 3.4Å; N216-N219 VanDerWaalsContact O-N 3.13Å; N216-D220 WeakPolarHBondContact O-CB 3.39Å; N216-D220 VanDerWaalsContact O-CG 3.27Å; N216-D220 PolarHBondContact O-N 3.35Å
217	Y	97.1	Very high	95.7	Very high	13 Å²	13	34.5 Å²	34.5	5%	0.051	18%	0.179	C	C	.	.	H	α-helix	trans	-57.2	-40.5	177	-77.1	-53.3	0	0	0	112.5	K213 A214 D220 S221 L242 Y279	K213-Y217 HydrophobicContact CD-CE2 4.14Å; K213-Y217 WeakPolarHBondContact CE-OH 3.32Å; K213-Y217 HydrophobicContact CG-CD2 4.1Å; K213-Y217 HydrophobicContact CG-CE2 3.61Å; K213-Y217 WeakPolarHBondContact O-CD2 3.36Å; K213-Y217 PolarHBondContact O-N 2.88Å; A214-Y217 PolarHBondContact O-N 3.16Å; Y217-D220 PolarHBondContact O-N 3.38Å; Y217-S221 WeakPolarHBondContact O-CB 3.49Å; Y217-S221 PolarHBondContact O-N 3.32Å; Y217-L242 HydrophobicContact CD1-CD2 3.67Å; Y217-L242 HydrophobicContact CD1-CG 4.37Å; Y217-L242 HydrophobicContact CD2-CB 4.25Å; Y217-L242 HydrophobicContact CD2-CD2 4.19Å; Y217-L242 HydrophobicContact CD2-CG 4.11Å; Y217-L242 HydrophobicContact CE1-CD2 3.68Å; Y217-L242 HydrophobicContact CE1-CG 4.13Å; Y217-L242 HydrophobicContact CE2-CB 4.3Å; Y217-L242 HydrophobicContact CE2-CD2 4.18Å; Y217-L242 HydrophobicContact CE2-CG 3.82Å; Y217-L242 HydrophobicContact CG-CD2 3.96Å; Y217-L242 HydrophobicContact CG-CG 4.39Å; Y217-Y279 AromaticContact CD1-CE2 3.87Å; Y217-Y279 HydrophobicContact CD1-CE2 3.87Å; Y217-Y279 WeakPolarHBondContact CD1-OH 3.43Å; Y217-Y279 AromaticContact CE1-CE2 3.66Å; Y217-Y279 HydrophobicContact CE1-CE2 3.66Å
218	M	96.2	Very high	95.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.6	-39	177.5	170.3	-68.7	-57	0	0	112	P191 H192 I195 A214 W215 N216 D220 S221 C239	P191-M218 HydrophobicContact CB-CG 4.32Å; P191-M218 HydrophobicContact CG-CG 3.58Å; P191-M218 HydrophobicContact CG-SD 4.15Å; H192-M218 HydrophobicContact CB-CE 4.15Å; H192-M218 WeakPolarHBondContact CD2-CE 3.08Å; H192-M218 PolarHBondContact CE1-SD 2.84Å; H192-M218 PolarHBondContact ND1-SD 3.06Å; H192-M218 VanDerWaalsContact ND1-SD 3.39Å; H192-M218 WeakPolarHBondContact NE2-CE 3.41Å; H192-M218 PolarHBondContact NE2-SD 2.98Å; I195-M218 HydrophobicContact CD1-CB 3.55Å; I195-M218 HydrophobicContact CD1-CE 4.31Å; I195-M218 HydrophobicContact CD1-CG 3.8Å; A214-M218 PolarHBondContact O-N 3.37Å; W215-M218 HydrophobicContact CD2-CE 4.11Å; W215-M218 HydrophobicContact CG-CE 4.07Å; W215-M218 WeakPolarHBondContact O-CE 3.31Å; W215-M218 PolarHBondContact O-N 2.91Å; N216-M218 VanDerWaalsContact C-N 3.26Å; N216-M218 PolarHBondContact O-N 3.37Å; M218-D220 VanDerWaalsContact C-N 3.25Å; M218-D220 PolarHBondContact O-N 3.28Å; M218-S221 PolarHBondContact O-N 3.47Å; M218-S221 PolarHBondContact O-OG 3.32Å; M218-C239 VanDerWaalsContact CA-SG 3.57Å; M218-C239 HydrophobicContact CB-CB 4.04Å
219	N	95.6	Very high	95.6	Very high	30 Å²	30	29.5 Å²	29.5	16%	0.16	14%	0.144	C	C	.	.	H	α-helix	trans	-64.1	-34.5	173.1	-78.5	-26.6	0	0	0	112	H192 W215 N216	H192-N219 PolarHBondContact NE2-OD1 3.01Å; H192-N219 VanDerWaalsContact NE2-OD1 3.09Å; W215-N219 VanDerWaalsContact CD1-ND2 3.31Å; W215-N219 PolarHBondContact O-N 3.22Å; N216-N219 PolarHBondContact O-N 3.4Å; N216-N219 VanDerWaalsContact O-N 3.13Å
220	D	94.9	Very high	95.5	Very high	34 Å²	34	28.7 Å²	28.7	18%	0.182	13%	0.13	C	C	.	.	H	α-helix	trans	-74.4	-29.7	177.9	-66.7	-32.3	0	0	0	111.5	N216 Y217 M218 L222 R223 M278 Y279	N216-D220 WeakPolarHBondContact O-CB 3.39Å; N216-D220 VanDerWaalsContact O-CG 3.27Å; N216-D220 PolarHBondContact O-N 3.35Å; Y217-D220 PolarHBondContact O-N 3.38Å; M218-D220 VanDerWaalsContact C-N 3.25Å; M218-D220 PolarHBondContact O-N 3.28Å; D220-L222 PolarHBondContact O-N 3.07Å; D220-R223 PolarHBondContact O-N 2.97Å; D220-R223 VanDerWaalsContact O-N 3.13Å; D220-R223 IonicContact OD1-CZ 3.14Å; D220-R223 IonicContact OD1-NH1 2.7Å; D220-R223 PolarHBondContact OD1-NH1 2.87Å; D220-R223 IonicContact OD1-NH2 2.8Å; D220-M278 HydrophobicContact CB-CE 3.87Å; D220-Y279 WeakPolarHBondContact CB-OH 3.49Å; D220-Y279 PolarHBondContact OD2-OH 3.32Å
221	S	96.3	Very high	95.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-24.3	176.4	87.9	0	0	0	0	113.5	Y217 M218 R223 T224 F227	Y217-S221 WeakPolarHBondContact O-CB 3.49Å; Y217-S221 PolarHBondContact O-N 3.32Å; M218-S221 PolarHBondContact O-N 3.47Å; M218-S221 PolarHBondContact O-OG 3.32Å; S221-R223 PolarHBondContact O-N 3.47Å; S221-R223 VanDerWaalsContact O-N 3.12Å; S221-T224 PolarHBondContact O-N 3.28Å; S221-T224 PolarHBondContact O-OG1 3.44Å; S221-F227 WeakPolarHBondContact OG-CE2 3.39Å
222	L	95.5	Very high	95.2	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.6	173.7	-68.2	161.2	0	0	0	113.8	A88 V92 D220 T224 F227	A88-L222 HydrophobicContact CB-CD1 3.59Å; A88-L222 HydrophobicContact CB-CD2 3.9Å; A88-L222 HydrophobicContact CB-CG 4.44Å; V92-L222 HydrophobicContact CG2-CD2 3.98Å; D220-L222 PolarHBondContact O-N 3.07Å; L222-T224 VanDerWaalsContact C-N 3.33Å; L222-F227 HydrophobicContact CB-CE2 4.44Å; L222-F227 HydrophobicContact CD2-CD2 4.05Å; L222-F227 HydrophobicContact CD2-CE1 4.02Å; L222-F227 HydrophobicContact CD2-CE2 3.42Å; L222-F227 VanDerWaalsContact CD2-CE2 3.42Å; L222-F227 HydrophobicContact CD2-CZ 3.4Å; L222-F227 VanDerWaalsContact CD2-CZ 3.4Å; L222-F227 HydrophobicContact CG-CE2 3.82Å; L222-F227 HydrophobicContact CG-CZ 4.05Å
223	R	93.5	Very high	95.2	Very high	23 Å²	23	26.7 Å²	26.7	9%	0.087	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.5	174.6	-55.2	-170.7	-169.6	90.9	15.2	113.4	F67 C70 D220 S221 M278	F67-R223 HydrophobicContact CD2-CB 3.72Å; F67-R223 HydrophobicContact CE2-CB 3.85Å; F67-R223 HydrophobicContact CE2-CG 4.35Å; C70-R223 HydrophobicContact CB-CB 4.4Å; C70-R223 HydrophobicContact CB-CG 4.21Å; D220-R223 PolarHBondContact O-N 2.97Å; D220-R223 VanDerWaalsContact O-N 3.13Å; D220-R223 IonicContact OD1-CZ 3.14Å; D220-R223 IonicContact OD1-NH1 2.7Å; D220-R223 PolarHBondContact OD1-NH1 2.87Å; D220-R223 IonicContact OD1-NH2 2.8Å; S221-R223 PolarHBondContact O-N 3.47Å; S221-R223 VanDerWaalsContact O-N 3.12Å; R223-M278 HydrophobicContact CB-SD 4.1Å
224	T	94.2	Very high	95.2	Very high	16 Å²	16	23.5 Å²	23.5	10%	0.098	11%	0.111	C	C	.	.	S	Bend	trans	-107.3	179.4	177.9	72.1	0	0	0	0	110.1	Q95 S221 L222 V226 I274 L275 M278	Q95-T224 PolarHBondContact NE2-O 2.88Å; S221-T224 PolarHBondContact O-N 3.28Å; S221-T224 PolarHBondContact O-OG1 3.44Å; L222-T224 VanDerWaalsContact C-N 3.33Å; T224-V226 WeakPolarHBondContact OG1-CG1 3.16Å; T224-V226 WeakPolarHBondContact OG1-CG2 3.42Å; T224-I274 HydrophobicContact CG2-CG2 3.95Å; T224-L275 HydrophobicContact CG2-CD2 4.49Å; T224-M278 HydrophobicContact CG2-CB 4.26Å; T224-M278 HydrophobicContact CG2-CE 4.26Å; T224-M278 HydrophobicContact CG2-CG 4.38Å; T224-M278 HydrophobicContact CG2-SD 3.5Å; T224-M278 VanDerWaalsContact CG2-SD 3.5Å
225	D	93.7	Very high	95.1	Very high	22 Å²	22	23.5 Å²	23.5	12%	0.118	11%	0.111	C	C	.	.	S	Bend	trans	-92.7	8.4	179.4	62.2	-2.4	0	0	0	113.8	Y99 F227 M228 R229	Y99-D225 HydrophobicContact CE2-CB 4.05Å; Y99-D225 WeakPolarHBondContact OH-CB 3.47Å; Y99-D225 PolarHBondContact OH-OD2 2.95Å; D225-F227 PolarHBondContact O-N 3.15Å; D225-F227 VanDerWaalsContact O-N 3.13Å; D225-M228 WeakPolarHBondContact O-CA 3.24Å; D225-M228 WeakPolarHBondContact O-CB 3.46Å; D225-M228 PolarHBondContact O-N 3.26Å; D225-R229 PolarHBondContact O-N 2.8Å; D225-R229 IonicContact OD1-NE 2.84Å; D225-R229 PolarHBondContact OD1-NE 3.32Å; D225-R229 VanDerWaalsContact OD1-NE 3.12Å; D225-R229 IonicContact OD2-CZ 3.17Å; D225-R229 IonicContact OD2-NE 3.38Å; D225-R229 PolarHBondContact OD2-NE 3.07Å; D225-R229 IonicContact OD2-NH2 2.67Å; D225-R229 PolarHBondContact OD2-NH2 3.41Å
226	V	95.3	Very high	95.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-57.6	-32.8	-177	-61.9	0	0	0	0	113.1	T224 M228 R229 Y230 I235 I271 I274	T224-V226 WeakPolarHBondContact OG1-CG1 3.16Å; T224-V226 WeakPolarHBondContact OG1-CG2 3.42Å; V226-M228 PolarHBondContact O-N 3.25Å; V226-R229 PolarHBondContact O-N 2.96Å; V226-Y230 HydrophobicContact CB-CD2 4.18Å; V226-Y230 HydrophobicContact CG1-CD2 4.5Å; V226-Y230 PolarHBondContact O-N 2.93Å; V226-I235 HydrophobicContact CG2-CD1 4.21Å; V226-I235 HydrophobicContact CG2-CG1 4.42Å; V226-I271 HydrophobicContact CG1-CG1 4.33Å; V226-I271 HydrophobicContact CG1-CG2 4.16Å; V226-I274 HydrophobicContact CG1-CB 4.28Å; V226-I274 HydrophobicContact CG1-CD1 4Å; V226-I274 HydrophobicContact CG1-CG2 3.87Å
227	F	94.6	Very high	95.2	Very high	5 Å²	5	17.1 Å²	17.1	2%	0.022	8%	0.083	C	C	.	.	H	α-helix	trans	-67.2	-17.8	176.9	-80.6	-95.1	0	0	0	113.6	V92 P191 S221 L222 D225 I235	V92-F227 HydrophobicContact CG2-CB 4.22Å; V92-F227 HydrophobicContact CG2-CD1 3.78Å; V92-F227 HydrophobicContact CG2-CE1 4.28Å; V92-F227 HydrophobicContact CG2-CG 3.95Å; P191-F227 HydrophobicContact CG-CE1 4.03Å; P191-F227 HydrophobicContact CG-CZ 3.77Å; S221-F227 WeakPolarHBondContact OG-CE2 3.39Å; L222-F227 HydrophobicContact CB-CE2 4.44Å; L222-F227 HydrophobicContact CD2-CD2 4.05Å; L222-F227 HydrophobicContact CD2-CE1 4.02Å; L222-F227 HydrophobicContact CD2-CE2 3.42Å; L222-F227 VanDerWaalsContact CD2-CE2 3.42Å; L222-F227 HydrophobicContact CD2-CZ 3.4Å; L222-F227 VanDerWaalsContact CD2-CZ 3.4Å; L222-F227 HydrophobicContact CG-CE2 3.82Å; L222-F227 HydrophobicContact CG-CZ 4.05Å; D225-F227 PolarHBondContact O-N 3.15Å; D225-F227 VanDerWaalsContact O-N 3.13Å; F227-I235 HydrophobicContact CD1-CD1 4.24Å; F227-I235 HydrophobicContact CD2-CD1 4.37Å; F227-I235 HydrophobicContact CE1-CD1 4.46Å; F227-I235 HydrophobicContact CG-CD1 4.19Å
228	M	93.4	Very high	95.3	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-93.9	-13	175	-50.7	-66.2	90.3	0	0	112	L42 L47 V92 Q95 R96 Y99 D225 V226	L42-M228 HydrophobicContact CD1-CB 4.11Å; L42-M228 HydrophobicContact CD1-CG 4.48Å; L42-M228 HydrophobicContact CD1-SD 4.47Å; L42-M228 HydrophobicContact CG-CB 4.39Å; L42-M228 PolarHBondContact N-O 2.92Å; L47-M228 HydrophobicContact CD2-CB 3.9Å; V92-M228 HydrophobicContact CG1-CE 3.93Å; Q95-M228 HydrophobicContact CB-CG 4.41Å; Q95-M228 HydrophobicContact CB-SD 4.16Å; R96-M228 HydrophobicContact CB-SD 4.19Å; R96-M228 HydrophobicContact CG-CE 3.57Å; R96-M228 HydrophobicContact CG-SD 3.43Å; R96-M228 WeakPolarHBondContact CG-SD 3.49Å; Y99-M228 HydrophobicContact CD2-CB 4.33Å; Y99-M228 HydrophobicContact CD2-CG 3.62Å; Y99-M228 HydrophobicContact CD2-SD 4.1Å; Y99-M228 HydrophobicContact CE2-CB 4.21Å; Y99-M228 HydrophobicContact CE2-CG 3.58Å; D225-M228 WeakPolarHBondContact O-CA 3.24Å; D225-M228 WeakPolarHBondContact O-CB 3.46Å; D225-M228 PolarHBondContact O-N 3.26Å; V226-M228 PolarHBondContact O-N 3.25Å
229	R	93.3	Very high	95.3	Very high	62 Å²	62	16.5 Å²	16.5	23%	0.234	8%	0.081	C	C	.	.	H	α-helix	trans	-107.2	-35.3	-172	-68.1	179.5	-178.6	-78.4	-7.2	113.4	I41 L47 D225 V226	I41-R229 WeakPolarHBondContact CG2-O 3.24Å; L47-R229 HydrophobicContact CD1-CG 3.66Å; L47-R229 HydrophobicContact CD2-CG 4.22Å; D225-R229 PolarHBondContact O-N 2.8Å; D225-R229 IonicContact OD1-NE 2.84Å; D225-R229 PolarHBondContact OD1-NE 3.32Å; D225-R229 VanDerWaalsContact OD1-NE 3.12Å; D225-R229 IonicContact OD2-CZ 3.17Å; D225-R229 IonicContact OD2-NE 3.38Å; D225-R229 PolarHBondContact OD2-NE 3.07Å; D225-R229 IonicContact OD2-NH2 2.67Å; D225-R229 PolarHBondContact OD2-NH2 3.41Å; V226-R229 PolarHBondContact O-N 2.96Å
230	Y	94.6	Very high	95.4	Very high	34 Å²	34	15.1 Å²	15.1	13%	0.133	7%	0.073	C	C	.	.	S	Bend	trans	-133.7	154.2	-166.1	-54.4	-72.7	0	0	0	111.9	V226 N267 A270 I271 I274	V226-Y230 HydrophobicContact CB-CD2 4.18Å; V226-Y230 HydrophobicContact CG1-CD2 4.5Å; V226-Y230 PolarHBondContact O-N 2.93Å; Y230-N267 HydrophobicContact CD1-CB 3.89Å; Y230-N267 HydrophobicContact CE1-CB 3.78Å; Y230-N267 WeakPolarHBondContact CE1-OD1 3.22Å; Y230-A270 WeakPolarHBondContact OH-CB 3.35Å; Y230-I271 HydrophobicContact CD1-CD1 4.3Å; Y230-I271 HydrophobicContact CD2-CD1 3.64Å; Y230-I271 HydrophobicContact CD2-CG1 3.33Å; Y230-I271 HydrophobicContact CE2-CD1 4.21Å; Y230-I271 HydrophobicContact CE2-CG1 3.47Å; Y230-I271 VanDerWaalsContact CE2-CG1 3.47Å; Y230-I271 HydrophobicContact CG-CD1 3.69Å; Y230-I271 HydrophobicContact CG-CG1 3.91Å; Y230-I274 HydrophobicContact CE2-CD1 4.22Å
231	S	94	Very high	95.5	Very high	32 Å²	32	14.5 Å²	14.5	22%	0.224	7%	0.069	C	C	.	.			trans	-66.6	152.2	174.8	77.2	0	0	0	0	111.5	E233 T234 I235	S231-E233 WeakPolarHBondContact CB-OE2 3.28Å; S231-E233 PolarHBondContact O-N 3.34Å; S231-E233 PolarHBondContact OG-OE2 3.49Å; S231-T234 PolarHBondContact O-N 3.15Å; S231-T234 VanDerWaalsContact O-N 3.17Å; S231-T234 PolarHBondContact OG-N 2.8Å; S231-T234 PolarHBondContact OG-OG1 2.74Å; S231-I235 WeakPolarHBondContact O-CG1 3.45Å; S231-I235 PolarHBondContact O-N 3.2Å
232	P	94.8	Very high	95.5	Very high	7 Å²	7	15.2 Å²	15.2	5%	0.045	7%	0.073	C	C	.	.	H	α-helix	trans	-59	-31.2	177.2	23.2	-31.6	0	0	0	112.9	K189 P191 L194 I235 A236	K189-P232 HydrophobicContact CB-CG 4.17Å; P191-P232 HydrophobicContact CB-CB 4.2Å; P191-P232 WeakPolarHBondContact CB-O 3.5Å; L194-P232 HydrophobicContact CD1-CB 4.05Å; P232-I235 PolarHBondContact O-N 3.02Å; P232-A236 WeakPolarHBondContact O-CB 3.44Å; P232-A236 PolarHBondContact O-N 2.9Å
233	E	95.1	Very high	95.5	Very high	69 Å²	69	15 Å²	15	32%	0.322	7%	0.072	S	C	.	.	H	α-helix	trans	-61.5	-48.6	175.1	-60.6	72.9	-157.7	0	0	111	L194 Y198 S231 I235 A236 C237	L194-E233 HydrophobicContact CD1-CB 4.45Å; L194-E233 HydrophobicContact CD1-CG 4.06Å; Y198-E233 WeakPolarHBondContact OH-CA 3.26Å; Y198-E233 VanDerWaalsContact OH-CB 3.29Å; Y198-E233 WeakPolarHBondContact OH-CB 3.26Å; S231-E233 WeakPolarHBondContact CB-OE2 3.28Å; S231-E233 PolarHBondContact O-N 3.34Å; S231-E233 PolarHBondContact OG-OE2 3.49Å; E233-I235 PolarHBondContact O-N 3.22Å; E233-A236 PolarHBondContact O-N 3.23Å; E233-C237 PolarHBondContact O-N 2.87Å; E233-C237 PolarHBondContact O-SG 2.84Å
234	T	96.4	Very high	95.7	Very high	8 Å²	8	14 Å²	14	5%	0.049	7%	0.069	C	C	.	.	H	α-helix	trans	-65	-41.7	178.2	-52.4	0	0	0	0	111.3	S231 A236 C237 A238 A263 N267 V268 I271	S231-T234 PolarHBondContact O-N 3.15Å; S231-T234 VanDerWaalsContact O-N 3.17Å; S231-T234 PolarHBondContact OG-N 2.8Å; S231-T234 PolarHBondContact OG-OG1 2.74Å; T234-A236 PolarHBondContact O-N 3.5Å; T234-C237 PolarHBondContact O-N 2.75Å; T234-A238 PolarHBondContact O-N 3.13Å; T234-A263 HydrophobicContact CG2-CB 4.33Å; T234-N267 HydrophobicContact CG2-CB 3.67Å; T234-V268 HydrophobicContact CG2-CG2 4.46Å; T234-I271 HydrophobicContact CG2-CD1 3.75Å
235	I	97.1	Very high	95.7	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-62.2	-44.3	177.3	-64.2	166.7	0	0	0	111	P191 V226 F227 S231 P232 E233 A238 C239 I271	P191-I235 HydrophobicContact CB-CG2 4.4Å; P191-I235 HydrophobicContact CG-CG2 4.09Å; V226-I235 HydrophobicContact CG2-CD1 4.21Å; V226-I235 HydrophobicContact CG2-CG1 4.42Å; F227-I235 HydrophobicContact CD1-CD1 4.24Å; F227-I235 HydrophobicContact CD2-CD1 4.37Å; F227-I235 HydrophobicContact CE1-CD1 4.46Å; F227-I235 HydrophobicContact CG-CD1 4.19Å; S231-I235 WeakPolarHBondContact O-CG1 3.45Å; S231-I235 PolarHBondContact O-N 3.2Å; P232-I235 PolarHBondContact O-N 3.02Å; E233-I235 PolarHBondContact O-N 3.22Å; I235-A238 PolarHBondContact O-N 2.85Å; I235-C239 PolarHBondContact O-N 3.35Å; I235-C239 PolarHBondContact O-SG 2.81Å; I235-I271 HydrophobicContact CG1-CD1 4.19Å
236	A	97.2	Very high	95.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.6	-43.1	176.5	0	0	0	0	0	111.6	P191 L194 I195 Y198 P232 E233 T234 A238 C239 V240	P191-A236 HydrophobicContact CB-CB 4.03Å; L194-A236 HydrophobicContact CB-CB 3.7Å; L194-A236 HydrophobicContact CD1-CB 4.46Å; I195-A236 HydrophobicContact CG1-CB 3.94Å; Y198-A236 HydrophobicContact CD2-CB 3.93Å; Y198-A236 HydrophobicContact CE2-CB 3.55Å; P232-A236 WeakPolarHBondContact O-CB 3.44Å; P232-A236 PolarHBondContact O-N 2.9Å; E233-A236 PolarHBondContact O-N 3.23Å; T234-A236 PolarHBondContact O-N 3.5Å; A236-A238 PolarHBondContact O-N 3.47Å; A236-C239 PolarHBondContact O-N 3.2Å; A236-V240 WeakPolarHBondContact O-CG2 3.36Å; A236-V240 PolarHBondContact O-N 3.29Å
237	C	97.3	Very high	95.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.1	-48.2	175.5	-71	0	0	0	0	112	Y198 E233 T234 C239 V240 F241 W257 W258 A263 V268	Y198-C237 VanDerWaalsContact CE2-SG 3.59Å; E233-C237 PolarHBondContact O-N 2.87Å; E233-C237 PolarHBondContact O-SG 2.84Å; T234-C237 PolarHBondContact O-N 2.75Å; C237-C239 PolarHBondContact O-N 3.47Å; C237-V240 PolarHBondContact O-N 3.14Å; C237-F241 WeakPolarHBondContact O-CB 3.48Å; C237-F241 PolarHBondContact O-N 2.98Å; C237-W257 HydrophobicContact CB-CH2 4.24Å; C237-W258 HydrophobicContact CB-CB 3.94Å; C237-A263 HydrophobicContact CB-CB 3.96Å; C237-V268 HydrophobicContact CB-CG2 4.18Å
238	A	97.5	Very high	95.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-41.1	178.3	0	0	0	0	0	113	T234 I235 A236 F241 L242 V268 I271	T234-A238 PolarHBondContact O-N 3.13Å; I235-A238 PolarHBondContact O-N 2.85Å; A236-A238 PolarHBondContact O-N 3.47Å; A238-F241 PolarHBondContact O-N 3.5Å; A238-L242 VanDerWaalsContact O-CB 3.3Å; A238-L242 WeakPolarHBondContact O-CB 3.43Å; A238-L242 PolarHBondContact O-N 2.92Å; A238-V268 HydrophobicContact CB-CG1 4.35Å; A238-I271 HydrophobicContact CB-CB 3.62Å; A238-I271 HydrophobicContact CB-CD1 3.95Å; A238-I271 HydrophobicContact CB-CG1 4.41Å; A238-I271 HydrophobicContact CB-CG2 3.46Å; A238-I271 VanDerWaalsContact CB-CG2 3.46Å
239	C	97.6	Very high	95.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-38.8	179.1	-65.4	0	0	0	0	112.5	I195 M218 I235 A236 C237 G243	I195-C239 HydrophobicContact CD1-CB 4.34Å; M218-C239 VanDerWaalsContact CA-SG 3.57Å; M218-C239 HydrophobicContact CB-CB 4.04Å; I235-C239 PolarHBondContact O-N 3.35Å; I235-C239 PolarHBondContact O-SG 2.81Å; A236-C239 PolarHBondContact O-N 3.2Å; C237-C239 PolarHBondContact O-N 3.47Å; C239-G243 PolarHBondContact O-N 3.01Å
240	V	97.2	Very high	95.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.1	-44.6	173.9	170.5	0	0	0	0	110.8	I195 L199 L202 A214 A236 C237 G243 A244 L251 W257	I195-V240 HydrophobicContact CB-CG2 4.5Å; I195-V240 HydrophobicContact CG1-CG2 4.42Å; I195-V240 HydrophobicContact CG2-CG2 3.99Å; L199-V240 HydrophobicContact CD2-CG1 3.77Å; L199-V240 HydrophobicContact CD2-CG2 4.33Å; L199-V240 HydrophobicContact CG-CG1 4.5Å; L199-V240 HydrophobicContact CG-CG2 4.23Å; L202-V240 HydrophobicContact CD1-CG1 4.31Å; A214-V240 HydrophobicContact CB-CG2 4.04Å; A236-V240 WeakPolarHBondContact O-CG2 3.36Å; A236-V240 PolarHBondContact O-N 3.29Å; C237-V240 PolarHBondContact O-N 3.14Å; V240-G243 PolarHBondContact O-N 3.02Å; V240-A244 WeakPolarHBondContact O-CB 3.19Å; V240-A244 PolarHBondContact O-N 2.99Å; V240-L251 HydrophobicContact CG1-CD1 4.12Å; V240-W257 HydrophobicContact CB-CH2 3.69Å; V240-W257 HydrophobicContact CB-CZ2 4Å; V240-W257 HydrophobicContact CG1-CH2 3.54Å; V240-W257 HydrophobicContact CG1-CZ2 3.6Å; V240-W257 HydrophobicContact CG1-CZ3 4.48Å
241	F	96.4	Very high	95.4	Very high	22 Å²	22	35.7 Å²	35.7	10%	0.096	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-50.6	177	176.7	-102.6	0	0	0	111.5	C237 A238 G243 A244 R245 M253 W257 W258 V268 L269	C237-F241 WeakPolarHBondContact O-CB 3.48Å; C237-F241 PolarHBondContact O-N 2.98Å; A238-F241 PolarHBondContact O-N 3.5Å; F241-G243 VanDerWaalsContact C-N 3.33Å; F241-G243 PolarHBondContact O-N 3.49Å; F241-A244 PolarHBondContact O-N 3.27Å; F241-R245 HydrophobicContact CD1-CG 4.41Å; F241-R245 HydrophobicContact CD2-CG 4.45Å; F241-R245 HydrophobicContact CE1-CG 4.09Å; F241-R245 HydrophobicContact CE2-CG 4.14Å; F241-R245 HydrophobicContact CZ-CG 3.95Å; F241-R245 VanDerWaalsContact O-CG 3.29Å; F241-R245 WeakPolarHBondContact O-CG 3.28Å; F241-R245 PolarHBondContact O-N 3.48Å; F241-M253 HydrophobicContact CE2-SD 4.44Å; F241-W257 HydrophobicContact CB-CZ2 4.18Å; F241-W258 AromaticContact CD2-CE3 3.96Å; F241-W258 HydrophobicContact CD2-CE3 3.96Å; F241-W258 HydrophobicContact CD2-CH2 4.01Å; F241-W258 AromaticContact CD2-CZ3 3.33Å; F241-W258 HydrophobicContact CD2-CZ3 3.33Å; F241-W258 HydrophobicContact CE2-CE3 4.45Å; F241-W258 AromaticContact CE2-CH2 3.68Å; F241-W258 HydrophobicContact CE2-CH2 3.68Å; F241-W258 AromaticContact CE2-CZ3 3.43Å; F241-W258 HydrophobicContact CE2-CZ3 3.43Å; F241-W258 VanDerWaalsContact CE2-CZ3 3.43Å; F241-W258 HydrophobicContact CG-CZ3 4.31Å; F241-W258 HydrophobicContact CZ-CH2 4.39Å; F241-W258 HydrophobicContact CZ-CZ3 4.48Å; F241-V268 HydrophobicContact CB-CG1 4.17Å; F241-V268 HydrophobicContact CD1-CG1 4.09Å; F241-V268 HydrophobicContact CG-CG1 4.14Å; F241-L269 HydrophobicContact CE1-CD2 3.99Å; F241-L269 HydrophobicContact CZ-CD2 4.34Å
242	L	96	Very high	95.3	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-40.2	177.5	-171.4	60.6	0	0	0	111.7	Y217 A238 R245 S246 C272 L275 L276	Y217-L242 HydrophobicContact CD1-CD2 3.67Å; Y217-L242 HydrophobicContact CD1-CG 4.37Å; Y217-L242 HydrophobicContact CD2-CB 4.25Å; Y217-L242 HydrophobicContact CD2-CD2 4.19Å; Y217-L242 HydrophobicContact CD2-CG 4.11Å; Y217-L242 HydrophobicContact CE1-CD2 3.68Å; Y217-L242 HydrophobicContact CE1-CG 4.13Å; Y217-L242 HydrophobicContact CE2-CB 4.3Å; Y217-L242 HydrophobicContact CE2-CD2 4.18Å; Y217-L242 HydrophobicContact CE2-CG 3.82Å; Y217-L242 HydrophobicContact CG-CD2 3.96Å; Y217-L242 HydrophobicContact CG-CG 4.39Å; A238-L242 VanDerWaalsContact O-CB 3.3Å; A238-L242 WeakPolarHBondContact O-CB 3.43Å; A238-L242 PolarHBondContact O-N 2.92Å; L242-R245 PolarHBondContact O-N 3.34Å; L242-S246 WeakPolarHBondContact O-CB 3.47Å; L242-S246 PolarHBondContact O-N 3.35Å; L242-S246 PolarHBondContact O-OG 3.5Å; L242-C272 HydrophobicContact CD1-CB 4.4Å; L242-L275 HydrophobicContact CD2-CB 4.06Å; L242-L275 HydrophobicContact CD2-CD1 3.9Å; L242-L276 HydrophobicContact CD1-CD1 4.14Å; L242-L276 HydrophobicContact CD1-CD2 4.21Å; L242-L276 HydrophobicContact CD1-CG 4.21Å
243	G	96.8	Very high	95.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-54.1	-54.4	171.8	0	0	0	0	0	112.5	L210 C239 V240 F241 S246 L247	L210-G243 VanDerWaalsContact CD1-C 3.48Å; C239-G243 PolarHBondContact O-N 3.01Å; V240-G243 PolarHBondContact O-N 3.02Å; F241-G243 VanDerWaalsContact C-N 3.33Å; F241-G243 PolarHBondContact O-N 3.49Å; G243-S246 PolarHBondContact O-N 3.36Å; G243-S246 PolarHBondContact O-OG 3.23Å; G243-L247 PolarHBondContact O-N 3.38Å; G243-L247 VanDerWaalsContact O-N 3.17Å
244	A	96.3	Very high	94.7	Very high	2 Å²	2	47.8 Å²	47.8	2%	0.017	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-44.3	-179.1	0	0	0	0	0	112	L210 V240 F241 S246 L247 K248 I249 L251	L210-A244 HydrophobicContact CD1-CB 4.01Å; L210-A244 VanDerWaalsContact CD1-N 3.27Å; V240-A244 WeakPolarHBondContact O-CB 3.19Å; V240-A244 PolarHBondContact O-N 2.99Å; F241-A244 PolarHBondContact O-N 3.27Å; A244-S246 PolarHBondContact O-N 2.9Å; A244-L247 CarbonylContact O-C 3.54Å; A244-L247 PolarHBondContact O-N 2.84Å; A244-K248 PolarHBondContact O-N 3.43Å; A244-I249 HydrophobicContact CB-CB 4.27Å; A244-I249 PolarHBondContact O-N 3.23Å; A244-L251 HydrophobicContact CB-CD1 3.49Å; A244-L251 VanDerWaalsContact CB-CD1 3.49Å; A244-L251 HydrophobicContact CB-CG 3.86Å
245	R	95.1	Very high	94.3	Very high	137 Å²	137	51.8 Å²	51.8	52%	0.517	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-43.9	176.2	-68.6	-66.4	178.9	162.5	-3.3	112	F241 L242 L247 K248	F241-R245 HydrophobicContact CD1-CG 4.41Å; F241-R245 HydrophobicContact CD2-CG 4.45Å; F241-R245 HydrophobicContact CE1-CG 4.09Å; F241-R245 HydrophobicContact CE2-CG 4.14Å; F241-R245 HydrophobicContact CZ-CG 3.95Å; F241-R245 VanDerWaalsContact O-CG 3.29Å; F241-R245 WeakPolarHBondContact O-CG 3.28Å; F241-R245 PolarHBondContact O-N 3.48Å; L242-R245 PolarHBondContact O-N 3.34Å; R245-L247 PolarHBondContact O-N 3.42Å; R245-K248 PolarHBondContact O-N 2.82Å; R245-K248 VanDerWaalsContact O-N 3.08Å
246	S	94.2	Very high	94.1	Very high	50 Å²	50	52.7 Å²	52.7	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-27.1	178.6	76.8	0	0	0	0	113.7	K213 L242 G243 A244	K213-S246 VanDerWaalsContact CE-OG 3.32Å; K213-S246 WeakPolarHBondContact CE-OG 3.45Å; L242-S246 WeakPolarHBondContact O-CB 3.47Å; L242-S246 PolarHBondContact O-N 3.35Å; L242-S246 PolarHBondContact O-OG 3.5Å; G243-S246 PolarHBondContact O-N 3.36Å; G243-S246 PolarHBondContact O-OG 3.23Å; A244-S246 PolarHBondContact O-N 2.9Å
247	L	95.1	Very high	93.9	Very high	66 Å²	66	53.2 Å²	53.2	35%	0.346	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	3.1	177.4	-64.9	175.1	0	0	0	113	A209 L210 K213 G243 A244 R245 I249	A209-L247 HydrophobicContact CB-CD1 4.29Å; L210-L247 HydrophobicContact CB-CD1 4.04Å; L210-L247 HydrophobicContact CD1-CD1 4.34Å; K213-L247 HydrophobicContact CB-CD1 4.21Å; G243-L247 PolarHBondContact O-N 3.38Å; G243-L247 VanDerWaalsContact O-N 3.17Å; A244-L247 CarbonylContact O-C 3.54Å; A244-L247 PolarHBondContact O-N 2.84Å; R245-L247 PolarHBondContact O-N 3.42Å; L247-I249 HydrophobicContact CB-CD1 3.71Å; L247-I249 HydrophobicContact CB-CG1 3.93Å; L247-I249 HydrophobicContact CD1-CD1 3.98Å; L247-I249 PolarHBondContact O-N 2.89Å
248	K	94.1	Very high	93.7	Very high	191 Å²	191	53.6 Å²	53.6	83%	0.83	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	33.6	-176	-54.7	-179.2	178.5	-176.5	0	113.7	A244 R245	A244-K248 PolarHBondContact O-N 3.43Å; R245-K248 PolarHBondContact O-N 2.82Å; R245-K248 VanDerWaalsContact O-N 3.08Å
249	I	93.5	Very high	93.5	Very high	47 Å²	47	58 Å²	58	24%	0.241	31%	0.306	C	S	.	.			trans	-88.2	126.4	176	-61.1	165.6	0	0	0	108.7	N207 L210 A244 L247 L251	N207-I249 WeakPolarHBondContact ND2-CD1 3.46Å; L210-I249 HydrophobicContact CB-CD1 3.99Å; L210-I249 HydrophobicContact CD1-CD1 4.41Å; L210-I249 HydrophobicContact CD2-CD1 4.1Å; L210-I249 HydrophobicContact CG-CD1 4.39Å; A244-I249 HydrophobicContact CB-CB 4.27Å; A244-I249 PolarHBondContact O-N 3.23Å; L247-I249 HydrophobicContact CB-CD1 3.71Å; L247-I249 HydrophobicContact CB-CG1 3.93Å; L247-I249 HydrophobicContact CD1-CD1 3.98Å; L247-I249 PolarHBondContact O-N 2.89Å; I249-L251 HydrophobicContact CG2-CD2 4.44Å; I249-L251 PolarHBondContact O-N 3.15Å
250	G	90.8	Very high	93.2	Very high	78 Å²	78	63.9 Å²	63.9	80%	0.804	34%	0.337	S	S	*	.			trans	-80.9	112.6	174	0	0	0	0	0	110.9
251	L	91	Very high	93	Very high	25 Å²	25	65.3 Å²	65.3	13%	0.131	34%	0.343	C	S	.	.			trans	-96.3	162.4	168.9	-65.2	177.5	0	0	0	110.2	L202 V240 A244 I249 M253 W257	L202-L251 HydrophobicContact CD1-CD1 4.35Å; L202-L251 HydrophobicContact CD1-CD2 4.41Å; V240-L251 HydrophobicContact CG1-CD1 4.12Å; A244-L251 HydrophobicContact CB-CD1 3.49Å; A244-L251 VanDerWaalsContact CB-CD1 3.49Å; A244-L251 HydrophobicContact CB-CG 3.86Å; I249-L251 HydrophobicContact CG2-CD2 4.44Å; I249-L251 PolarHBondContact O-N 3.15Å; L251-M253 WeakPolarHBondContact O-CG 3.49Å; L251-M253 PolarHBondContact O-N 3.01Å; L251-W257 VanDerWaalsContact CB-CD1 3.48Å; L251-W257 HydrophobicContact CB-CG 4.36Å; L251-W257 HydrophobicContact CD1-CZ2 3.98Å
252	P	91.3	Very high	92.6	Very high	75 Å²	75	71.7 Å²	71.7	49%	0.487	38%	0.378	S	S	.	.			trans	-58.7	127.6	179.7	-22.6	32.9	0	0	0	112.4	W257	P252-W257 HydrophobicContact CB-CB 4.18Å; P252-W257 HydrophobicContact CG-CB 4.43Å; P252-W257 WeakPolarHBondContact O-CB 3.39Å; P252-W257 VanDerWaalsContact O-CD1 3.26Å; P252-W257 PolarHBondContact O-N 3.16Å
253	M	90.3	Very high	92.4	Very high	81 Å²	81	71.3 Å²	71.3	40%	0.399	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-119.8	-1.3	-176.4	-70	-68.4	-54.5	0	0	113.5	F241 L251 P255 P256 W258	F241-M253 HydrophobicContact CE2-SD 4.44Å; L251-M253 WeakPolarHBondContact O-CG 3.49Å; L251-M253 PolarHBondContact O-N 3.01Å; M253-P255 CarbonylContact C-O 3.25Å; M253-P255 VanDerWaalsContact C-O 3.25Å; M253-P255 CarbonylContact O-C 3.49Å; M253-P256 WeakPolarHBondContact O-CD 3.2Å; M253-W258 HydrophobicContact CE-CH2 3.68Å; M253-W258 HydrophobicContact CE-CZ3 4.28Å; M253-W258 HydrophobicContact SD-CH2 3.74Å; M253-W258 HydrophobicContact SD-CZ3 3.7Å
254	K	88.3	Confident	92.2	Very high	207 Å²	207	75.1 Å²	75.1	90%	0.9	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.5	86.7	-178.2	-66.4	-174.9	179.6	-178	0	110.8
255	P	87.9	Confident	92	Very high	92 Å²	92	77.6 Å²	77.6	60%	0.597	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	cis	-71	163.4	-6.1	31.6	-35.1	0	0	0	112.1	M253 W257	M253-P255 CarbonylContact C-O 3.25Å; M253-P255 VanDerWaalsContact C-O 3.25Å; M253-P255 CarbonylContact O-C 3.49Å; P255-W257 PolarHBondContact O-N 2.85Å
256	P	91.8	Very high	92	Very high	19 Å²	19	76.4 Å²	76.4	12%	0.123	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-54.7	126.4	171.2	-21.6	30.8	0	0	0	111.7	M253 W258 Q259	M253-P256 WeakPolarHBondContact O-CD 3.2Å; P256-W258 HydrophobicContact CB-CD2 3.83Å; P256-W258 HydrophobicContact CB-CE3 4.16Å; P256-W258 HydrophobicContact CB-CH2 3.77Å; P256-W258 HydrophobicContact CB-CZ2 3.37Å; P256-W258 HydrophobicContact CB-CZ3 4.11Å; P256-W258 HydrophobicContact CG-CZ2 4.07Å; P256-W258 PolarHBondContact O-N 3.02Å; P256-W258 VanDerWaalsContact O-N 3.1Å; P256-Q259 HydrophobicContact CB-CG 4.34Å; P256-Q259 WeakPolarHBondContact O-CB 3.46Å; P256-Q259 WeakPolarHBondContact O-CG 3.49Å; P256-Q259 PolarHBondContact O-N 2.82Å
257	W	93.8	Very high	92	Very high	12 Å²	12	76.8 Å²	76.8	5%	0.045	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-59.8	-27.6	-170.4	67.6	-94.5	0	0	0	114.4	L202 C237 V240 F241 L251 P252 P255 Q259 L260 F261	L202-W257 HydrophobicContact CD1-CD2 3.78Å; L202-W257 HydrophobicContact CD1-CE3 3.59Å; L202-W257 HydrophobicContact CD1-CG 4.42Å; L202-W257 HydrophobicContact CD1-CH2 4.21Å; L202-W257 HydrophobicContact CD1-CZ2 4.4Å; L202-W257 HydrophobicContact CD1-CZ3 3.81Å; L202-W257 HydrophobicContact CD2-CB 3.69Å; L202-W257 HydrophobicContact CD2-CD2 3.99Å; L202-W257 HydrophobicContact CD2-CE3 3.94Å; L202-W257 HydrophobicContact CD2-CG 3.92Å; L202-W257 HydrophobicContact CG-CE3 4.24Å; C237-W257 HydrophobicContact CB-CH2 4.24Å; V240-W257 HydrophobicContact CB-CH2 3.69Å; V240-W257 HydrophobicContact CB-CZ2 4Å; V240-W257 HydrophobicContact CG1-CH2 3.54Å; V240-W257 HydrophobicContact CG1-CZ2 3.6Å; V240-W257 HydrophobicContact CG1-CZ3 4.48Å; F241-W257 HydrophobicContact CB-CZ2 4.18Å; L251-W257 VanDerWaalsContact CB-CD1 3.48Å; L251-W257 HydrophobicContact CB-CG 4.36Å; L251-W257 HydrophobicContact CD1-CZ2 3.98Å; P252-W257 HydrophobicContact CB-CB 4.18Å; P252-W257 HydrophobicContact CG-CB 4.43Å; P252-W257 WeakPolarHBondContact O-CB 3.39Å; P252-W257 VanDerWaalsContact O-CD1 3.26Å; P252-W257 PolarHBondContact O-N 3.16Å; P255-W257 PolarHBondContact O-N 2.85Å; W257-Q259 PolarHBondContact O-N 3.43Å; W257-L260 VanDerWaalsContact O-CB 3.23Å; W257-L260 WeakPolarHBondContact O-CB 3.28Å; W257-L260 PolarHBondContact O-N 3.49Å; W257-F261 AromaticContact CE3-CD2 3.82Å; W257-F261 HydrophobicContact CE3-CD2 3.82Å; W257-F261 AromaticContact CE3-CE2 3.57Å; W257-F261 HydrophobicContact CE3-CE2 3.57Å; W257-F261 AromaticContact CZ3-CD2 3.64Å; W257-F261 HydrophobicContact CZ3-CD2 3.64Å; W257-F261 AromaticContact CZ3-CE2 3.56Å; W257-F261 HydrophobicContact CZ3-CE2 3.56Å
258	W	93.3	Very high	92.1	Very high	7 Å²	7	73.7 Å²	73.7	3%	0.027	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-70.7	-16.8	-179.6	56.2	76.3	0	0	0	113.1	C237 F241 M253 P256 L260 F261 A263 D265 V268	C237-W258 HydrophobicContact CB-CB 3.94Å; F241-W258 AromaticContact CD2-CE3 3.96Å; F241-W258 HydrophobicContact CD2-CE3 3.96Å; F241-W258 HydrophobicContact CD2-CH2 4.01Å; F241-W258 AromaticContact CD2-CZ3 3.33Å; F241-W258 HydrophobicContact CD2-CZ3 3.33Å; F241-W258 HydrophobicContact CE2-CE3 4.45Å; F241-W258 AromaticContact CE2-CH2 3.68Å; F241-W258 HydrophobicContact CE2-CH2 3.68Å; F241-W258 AromaticContact CE2-CZ3 3.43Å; F241-W258 HydrophobicContact CE2-CZ3 3.43Å; F241-W258 VanDerWaalsContact CE2-CZ3 3.43Å; F241-W258 HydrophobicContact CG-CZ3 4.31Å; F241-W258 HydrophobicContact CZ-CH2 4.39Å; F241-W258 HydrophobicContact CZ-CZ3 4.48Å; M253-W258 HydrophobicContact CE-CH2 3.68Å; M253-W258 HydrophobicContact CE-CZ3 4.28Å; M253-W258 HydrophobicContact SD-CH2 3.74Å; M253-W258 HydrophobicContact SD-CZ3 3.7Å; P256-W258 HydrophobicContact CB-CD2 3.83Å; P256-W258 HydrophobicContact CB-CE3 4.16Å; P256-W258 HydrophobicContact CB-CH2 3.77Å; P256-W258 HydrophobicContact CB-CZ2 3.37Å; P256-W258 HydrophobicContact CB-CZ3 4.11Å; P256-W258 HydrophobicContact CG-CZ2 4.07Å; P256-W258 PolarHBondContact O-N 3.02Å; P256-W258 VanDerWaalsContact O-N 3.1Å; W258-L260 PolarHBondContact O-N 3.16Å; W258-F261 PolarHBondContact O-N 3.17Å; W258-A263 HydrophobicContact CB-CB 4.22Å; W258-A263 PolarHBondContact O-N 3.16Å; W258-D265 PolarHBondContact NE1-OD1 2.95Å; W258-V268 HydrophobicContact CG-CG2 4.16Å
259	Q	92.4	Very high	92.2	Very high	93 Å²	93	68.5 Å²	68.5	44%	0.435	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-64.2	-23.8	171.8	-64.7	-178.1	-2.4	0	0	112	P256 W257 F261 D262 D265	P256-Q259 HydrophobicContact CB-CG 4.34Å; P256-Q259 WeakPolarHBondContact O-CB 3.46Å; P256-Q259 WeakPolarHBondContact O-CG 3.49Å; P256-Q259 PolarHBondContact O-N 2.82Å; W257-Q259 PolarHBondContact O-N 3.43Å; Q259-F261 PolarHBondContact O-N 3.27Å; Q259-D262 PolarHBondContact O-N 2.93Å; Q259-D265 PolarHBondContact NE2-OD1 3.47Å
260	L	91.7	Very high	92.3	Very high	124 Å²	124	67.6 Å²	67.6	65%	0.649	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-64.6	-19.6	172.8	-174.8	61.6	0	0	0	112.8	W257 W258	W257-L260 VanDerWaalsContact O-CB 3.23Å; W257-L260 WeakPolarHBondContact O-CB 3.28Å; W257-L260 PolarHBondContact O-N 3.49Å; W258-L260 PolarHBondContact O-N 3.16Å
261	F	92.8	Very high	92.6	Very high	29 Å²	29	63.9 Å²	63.9	13%	0.127	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-116	26.1	-176	-52	-56.7	0	0	0	112.2	Y198 A201 W257 W258 Q259 A263	Y198-F261 AromaticContact CD1-CD1 3.5Å; Y198-F261 HydrophobicContact CD1-CD1 3.5Å; Y198-F261 AromaticContact CD1-CD2 3.81Å; Y198-F261 HydrophobicContact CD1-CD2 3.81Å; Y198-F261 AromaticContact CD1-CE1 3.45Å; Y198-F261 HydrophobicContact CD1-CE1 3.45Å; Y198-F261 VanDerWaalsContact CD1-CE1 3.45Å; Y198-F261 AromaticContact CD1-CE2 3.75Å; Y198-F261 HydrophobicContact CD1-CE2 3.75Å; Y198-F261 AromaticContact CD1-CG 3.69Å; Y198-F261 HydrophobicContact CD1-CG 3.69Å; Y198-F261 AromaticContact CD1-CZ 3.58Å; Y198-F261 HydrophobicContact CD1-CZ 3.58Å; Y198-F261 HydrophobicContact CD2-CD2 4.1Å; Y198-F261 HydrophobicContact CD2-CE2 4.37Å; Y198-F261 HydrophobicContact CD2-CG 4.43Å; Y198-F261 HydrophobicContact CE1-CB 3.96Å; Y198-F261 AromaticContact CE1-CD1 3.36Å; Y198-F261 HydrophobicContact CE1-CD1 3.36Å; Y198-F261 HydrophobicContact CE1-CD2 4.07Å; Y198-F261 AromaticContact CE1-CE1 3.81Å; Y198-F261 HydrophobicContact CE1-CE1 3.81Å; Y198-F261 HydrophobicContact CE1-CE2 4.43Å; Y198-F261 AromaticContact CE1-CG 3.52Å; Y198-F261 HydrophobicContact CE1-CG 3.52Å; Y198-F261 HydrophobicContact CE1-CZ 4.32Å; Y198-F261 HydrophobicContact CE2-CB 4.31Å; Y198-F261 HydrophobicContact CE2-CD2 4.32Å; Y198-F261 HydrophobicContact CE2-CG 4.27Å; Y198-F261 HydrophobicContact CG-CD1 4.37Å; Y198-F261 AromaticContact CG-CD2 3.84Å; Y198-F261 HydrophobicContact CG-CD2 3.84Å; Y198-F261 HydrophobicContact CG-CE1 4.28Å; Y198-F261 AromaticContact CG-CE2 3.72Å; Y198-F261 HydrophobicContact CG-CE2 3.72Å; Y198-F261 HydrophobicContact CG-CG 4.17Å; Y198-F261 AromaticContact CG-CZ 3.97Å; Y198-F261 HydrophobicContact CG-CZ 3.97Å; Y198-F261 AromaticContact CZ-CG 3.82Å; A201-F261 HydrophobicContact CB-CE1 4.32Å; A201-F261 HydrophobicContact CB-CZ 3.87Å; W257-F261 AromaticContact CE3-CD2 3.82Å; W257-F261 HydrophobicContact CE3-CD2 3.82Å; W257-F261 AromaticContact CE3-CE2 3.57Å; W257-F261 HydrophobicContact CE3-CE2 3.57Å; W257-F261 AromaticContact CZ3-CD2 3.64Å; W257-F261 HydrophobicContact CZ3-CD2 3.64Å; W257-F261 AromaticContact CZ3-CE2 3.56Å; W257-F261 HydrophobicContact CZ3-CE2 3.56Å; W258-F261 PolarHBondContact O-N 3.17Å; Q259-F261 PolarHBondContact O-N 3.27Å; F261-A263 PolarHBondContact O-N 3.03Å; F261-A263 VanDerWaalsContact O-N 3.12Å
262	D	88.3	Confident	92.8	Very high	156 Å²	156	63 Å²	63	83%	0.834	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	26.8	177.7	-57.3	-45.3	0	0	0	114.5	Q259	Q259-D262 PolarHBondContact O-N 2.93Å
263	A	92.3	Very high	93.1	Very high	6 Å²	6	64.8 Å²	64.8	5%	0.05	34%	0.34	C	S	.	.			trans	-94.7	137.1	175.9	0	0	0	0	0	111.3	T234 C237 W258 F261 V268	T234-A263 HydrophobicContact CG2-CB 4.33Å; C237-A263 HydrophobicContact CB-CB 3.96Å; W258-A263 HydrophobicContact CB-CB 4.22Å; W258-A263 PolarHBondContact O-N 3.16Å; F261-A263 PolarHBondContact O-N 3.03Å; F261-A263 VanDerWaalsContact O-N 3.12Å; A263-V268 HydrophobicContact CB-CG2 4.02Å
264	N	92	Very high	93.3	Very high	80 Å²	80	63.2 Å²	63.2	43%	0.428	33%	0.332	S	S	.	.			trans	-87.2	139.7	175.9	-173.9	5.1	0	0	0	111.6	D266 N267 V268	N264-D266 VanDerWaalsContact C-N 3.32Å; N264-D266 PolarHBondContact O-N 2.81Å; N264-N267 HydrophobicContact CB-CB 4.44Å; N264-N267 PolarHBondContact O-N 3Å; N264-N267 VanDerWaalsContact O-N 3.16Å; N264-V268 WeakPolarHBondContact O-CG2 3.48Å; N264-V268 PolarHBondContact O-N 3.4Å
265	D	92.3	Very high	93.7	Very high	54 Å²	54	53.4 Å²	53.4	29%	0.289	29%	0.29	S	S	.	.	H	α-helix	trans	-49.1	-49.1	176	-68.4	29	0	0	0	111.9	W258 Q259 N267 V268 L269	W258-D265 PolarHBondContact NE1-OD1 2.95Å; Q259-D265 PolarHBondContact NE2-OD1 3.47Å; D265-N267 VanDerWaalsContact C-N 3.33Å; D265-N267 PolarHBondContact O-N 3.02Å; D265-V268 PolarHBondContact O-N 3.39Å; D265-L269 WeakPolarHBondContact O-CG 3.44Å; D265-L269 PolarHBondContact O-N 3.38Å
266	D	94.8	Very high	94	Very high	112 Å²	112	51.6 Å²	51.6	60%	0.599	28%	0.275	S	S	*	.	H	α-helix	trans	-62	-40.6	-178.3	-66.7	-33.2	0	0	0	112.2	N264 A270	N264-D266 VanDerWaalsContact C-N 3.32Å; N264-D266 PolarHBondContact O-N 2.81Å; D266-A270 VanDerWaalsContact O-CB 3.26Å; D266-A270 WeakPolarHBondContact O-CB 3.26Å; D266-A270 PolarHBondContact O-N 3.02Å
267	N	95.6	Very high	94.1	Very high	59 Å²	59	52.4 Å²	52.4	32%	0.316	29%	0.287	S	S	.	.	H	α-helix	trans	-71.9	-40.3	-179.3	-67.9	-19.3	0	0	0	111.4	Y230 T234 N264 D265 L269 A270 I271	Y230-N267 HydrophobicContact CD1-CB 3.89Å; Y230-N267 HydrophobicContact CE1-CB 3.78Å; Y230-N267 WeakPolarHBondContact CE1-OD1 3.22Å; T234-N267 HydrophobicContact CG2-CB 3.67Å; N264-N267 HydrophobicContact CB-CB 4.44Å; N264-N267 PolarHBondContact O-N 3Å; N264-N267 VanDerWaalsContact O-N 3.16Å; D265-N267 VanDerWaalsContact C-N 3.33Å; D265-N267 PolarHBondContact O-N 3.02Å; N267-L269 VanDerWaalsContact C-N 3.34Å; N267-A270 PolarHBondContact O-N 3.29Å; N267-I271 WeakPolarHBondContact O-CD1 3.26Å; N267-I271 VanDerWaalsContact O-CG1 3.26Å; N267-I271 WeakPolarHBondContact O-CG1 3.44Å; N267-I271 PolarHBondContact O-N 3.2Å
268	V	95.7	Very high	94	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-46.8	176.2	167.9	0	0	0	0	110.4	T234 C237 A238 F241 W258 A263 N264 D265 C272	T234-V268 HydrophobicContact CG2-CG2 4.46Å; C237-V268 HydrophobicContact CB-CG2 4.18Å; A238-V268 HydrophobicContact CB-CG1 4.35Å; F241-V268 HydrophobicContact CB-CG1 4.17Å; F241-V268 HydrophobicContact CD1-CG1 4.09Å; F241-V268 HydrophobicContact CG-CG1 4.14Å; W258-V268 HydrophobicContact CG-CG2 4.16Å; A263-V268 HydrophobicContact CB-CG2 4.02Å; N264-V268 WeakPolarHBondContact O-CG2 3.48Å; N264-V268 PolarHBondContact O-N 3.4Å; D265-V268 PolarHBondContact O-N 3.39Å; V268-C272 PolarHBondContact O-N 3.35Å; V268-C272 PolarHBondContact O-SG 3.41Å
269	L	95.8	Very high	93.9	Very high	82 Å²	82	54 Å²	54	43%	0.429	29%	0.294	S	S	.	.	H	α-helix	trans	-66.8	-43.1	177.7	-66.7	177.1	0	0	0	112	F241 D265 N267 I271 C272 D273	F241-L269 HydrophobicContact CE1-CD2 3.99Å; F241-L269 HydrophobicContact CZ-CD2 4.34Å; D265-L269 WeakPolarHBondContact O-CG 3.44Å; D265-L269 PolarHBondContact O-N 3.38Å; N267-L269 VanDerWaalsContact C-N 3.34Å; L269-I271 VanDerWaalsContact C-N 3.34Å; L269-I271 PolarHBondContact O-N 2.98Å; L269-C272 WeakPolarHBondContact O-CB 3.27Å; L269-C272 PolarHBondContact O-N 3.33Å; L269-C272 VanDerWaalsContact O-N 3.08Å; L269-D273 PolarHBondContact O-N 3.48Å
270	A	96.3	Very high	93.8	Very high	29 Å²	29	52.2 Å²	52.2	24%	0.24	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-41.1	177.8	0	0	0	0	0	112.8	Y230 D266 N267 C272 D273 I274	Y230-A270 WeakPolarHBondContact OH-CB 3.35Å; D266-A270 VanDerWaalsContact O-CB 3.26Å; D266-A270 WeakPolarHBondContact O-CB 3.26Å; D266-A270 PolarHBondContact O-N 3.02Å; N267-A270 PolarHBondContact O-N 3.29Å; A270-C272 VanDerWaalsContact C-N 3.33Å; A270-C272 PolarHBondContact O-N 3.44Å; A270-D273 PolarHBondContact O-N 3.41Å; A270-I274 VanDerWaalsContact O-CG1 3.3Å; A270-I274 WeakPolarHBondContact O-CG1 3Å; A270-I274 PolarHBondContact O-N 3.31Å
271	I	96.8	Very high	93.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.2	-40.3	175.1	-66.7	161.6	0	0	0	110.9	V226 Y230 T234 I235 A238 N267 L269 D273 I274 L275	V226-I271 HydrophobicContact CG1-CG1 4.33Å; V226-I271 HydrophobicContact CG1-CG2 4.16Å; Y230-I271 HydrophobicContact CD1-CD1 4.3Å; Y230-I271 HydrophobicContact CD2-CD1 3.64Å; Y230-I271 HydrophobicContact CD2-CG1 3.33Å; Y230-I271 HydrophobicContact CE2-CD1 4.21Å; Y230-I271 HydrophobicContact CE2-CG1 3.47Å; Y230-I271 VanDerWaalsContact CE2-CG1 3.47Å; Y230-I271 HydrophobicContact CG-CD1 3.69Å; Y230-I271 HydrophobicContact CG-CG1 3.91Å; T234-I271 HydrophobicContact CG2-CD1 3.75Å; I235-I271 HydrophobicContact CG1-CD1 4.19Å; A238-I271 HydrophobicContact CB-CB 3.62Å; A238-I271 HydrophobicContact CB-CD1 3.95Å; A238-I271 HydrophobicContact CB-CG1 4.41Å; A238-I271 HydrophobicContact CB-CG2 3.46Å; A238-I271 VanDerWaalsContact CB-CG2 3.46Å; N267-I271 WeakPolarHBondContact O-CD1 3.26Å; N267-I271 VanDerWaalsContact O-CG1 3.26Å; N267-I271 WeakPolarHBondContact O-CG1 3.44Å; N267-I271 PolarHBondContact O-N 3.2Å; L269-I271 VanDerWaalsContact C-N 3.34Å; L269-I271 PolarHBondContact O-N 2.98Å; I271-D273 VanDerWaalsContact C-N 3.35Å; I271-I274 PolarHBondContact O-N 3.21Å; I271-L275 HydrophobicContact CG2-CD1 4.25Å; I271-L275 WeakPolarHBondContact O-CG 3.47Å; I271-L275 PolarHBondContact O-N 3.25Å
272	C	96.7	Very high	93	Very high	7 Å²	7	56.4 Å²	56.4	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-43.9	176.3	-66.3	0	0	0	0	111.4	L242 V268 L269 A270 L275 L276	L242-C272 HydrophobicContact CD1-CB 4.4Å; V268-C272 PolarHBondContact O-N 3.35Å; V268-C272 PolarHBondContact O-SG 3.41Å; L269-C272 WeakPolarHBondContact O-CB 3.27Å; L269-C272 PolarHBondContact O-N 3.33Å; L269-C272 VanDerWaalsContact O-N 3.08Å; A270-C272 VanDerWaalsContact C-N 3.33Å; A270-C272 PolarHBondContact O-N 3.44Å; C272-L275 PolarHBondContact O-N 3.23Å; C272-L276 WeakPolarHBondContact O-CB 3.42Å; C272-L276 VanDerWaalsContact O-CG 3.31Å; C272-L276 WeakPolarHBondContact O-CG 3.28Å; C272-L276 PolarHBondContact O-N 3.46Å
273	D	96.3	Very high	92.5	Very high	112 Å²	112	54.3 Å²	54.3	60%	0.599	31%	0.309	S	S	*	.	H	α-helix	trans	-64.2	-40.9	177.7	-72.5	-20.7	0	0	0	112	L269 A270 I271 L275 L276 G277	L269-D273 PolarHBondContact O-N 3.48Å; A270-D273 PolarHBondContact O-N 3.41Å; I271-D273 VanDerWaalsContact C-N 3.35Å; D273-L275 PolarHBondContact O-N 2.75Å; D273-L276 PolarHBondContact O-N 3.06Å; D273-G277 WeakPolarHBondContact O-CA 3.25Å; D273-G277 PolarHBondContact O-N 3.36Å
274	I	95.1	Very high	91.7	Very high	48 Å²	48	56.7 Å²	56.7	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-46.1	174.5	-69.3	164.6	0	0	0	110.7	T224 V226 Y230 A270 I271 G277 M278	T224-I274 HydrophobicContact CG2-CG2 3.95Å; V226-I274 HydrophobicContact CG1-CB 4.28Å; V226-I274 HydrophobicContact CG1-CD1 4Å; V226-I274 HydrophobicContact CG1-CG2 3.87Å; Y230-I274 HydrophobicContact CE2-CD1 4.22Å; A270-I274 VanDerWaalsContact O-CG1 3.3Å; A270-I274 WeakPolarHBondContact O-CG1 3Å; A270-I274 PolarHBondContact O-N 3.31Å; I271-I274 PolarHBondContact O-N 3.21Å; I274-G277 PolarHBondContact O-N 2.88Å; I274-M278 PolarHBondContact O-N 3.47Å
275	L	95.5	Very high	91.1	Very high	0 Å²	0	56 Å²	56	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-47.9	178.8	-77.5	177.4	0	0	0	112.3	T224 L242 I271 C272 D273 G277 M278 Y279	T224-L275 HydrophobicContact CG2-CD2 4.49Å; L242-L275 HydrophobicContact CD2-CB 4.06Å; L242-L275 HydrophobicContact CD2-CD1 3.9Å; I271-L275 HydrophobicContact CG2-CD1 4.25Å; I271-L275 WeakPolarHBondContact O-CG 3.47Å; I271-L275 PolarHBondContact O-N 3.25Å; C272-L275 PolarHBondContact O-N 3.23Å; D273-L275 PolarHBondContact O-N 2.75Å; L275-G277 VanDerWaalsContact C-N 3.33Å; L275-M278 HydrophobicContact CD2-CE 3.99Å; L275-M278 WeakPolarHBondContact O-CB 3.28Å; L275-M278 PolarHBondContact O-N 3.45Å; L275-Y279 WeakPolarHBondContact O-CD2 3.41Å; L275-Y279 WeakPolarHBondContact O-CE2 3.35Å; L275-Y279 PolarHBondContact O-N 3.11Å; L275-Y279 VanDerWaalsContact O-N 3.17Å
276	L	95	Very high	90.5	Very high	55 Å²	55	55.3 Å²	55.3	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-36.5	178.2	-69.6	175.9	0	0	0	112	L242 C272 D273 Y279 S280	L242-L276 HydrophobicContact CD1-CD1 4.14Å; L242-L276 HydrophobicContact CD1-CD2 4.21Å; L242-L276 HydrophobicContact CD1-CG 4.21Å; C272-L276 WeakPolarHBondContact O-CB 3.42Å; C272-L276 VanDerWaalsContact O-CG 3.31Å; C272-L276 WeakPolarHBondContact O-CG 3.28Å; C272-L276 PolarHBondContact O-N 3.46Å; D273-L276 PolarHBondContact O-N 3.06Å; L276-Y279 PolarHBondContact O-N 3.27Å; L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.45Å; L276-S280 PolarHBondContact O-OG 2.83Å
277	G	93.4	Very high	89.7	Confident	36 Å²	36	53.9 Å²	53.9	37%	0.371	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-46.9	172.3	0	0	0	0	0	111.5	D273 I274 L275 Y279 S280 S281	D273-G277 WeakPolarHBondContact O-CA 3.25Å; D273-G277 PolarHBondContact O-N 3.36Å; I274-G277 PolarHBondContact O-N 2.88Å; L275-G277 VanDerWaalsContact C-N 3.33Å; G277-Y279 VanDerWaalsContact C-N 3.33Å; G277-Y279 PolarHBondContact O-N 2.9Å; G277-S280 PolarHBondContact O-N 2.69Å; G277-S281 PolarHBondContact O-N 3.45Å; G277-S281 VanDerWaalsContact O-N 3.08Å; G277-S281 PolarHBondContact O-OG 3.27Å; G277-S281 VanDerWaalsContact O-OG 3.1Å
278	M	92.5	Very high	89	Confident	25 Å²	25	53 Å²	53	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-57.2	-43.1	174.9	177.5	-173	64.4	0	0	112.3	F67 D220 R223 T224 I274 L275 S280 S281	F67-M278 HydrophobicContact CD2-CG 4.44Å; F67-M278 HydrophobicContact CD2-SD 4.28Å; F67-M278 HydrophobicContact CE2-CG 4.01Å; F67-M278 HydrophobicContact CE2-SD 3.84Å; D220-M278 HydrophobicContact CB-CE 3.87Å; R223-M278 HydrophobicContact CB-SD 4.1Å; T224-M278 HydrophobicContact CG2-CB 4.26Å; T224-M278 HydrophobicContact CG2-CE 4.26Å; T224-M278 HydrophobicContact CG2-CG 4.38Å; T224-M278 HydrophobicContact CG2-SD 3.5Å; T224-M278 VanDerWaalsContact CG2-SD 3.5Å; I274-M278 PolarHBondContact O-N 3.47Å; L275-M278 HydrophobicContact CD2-CE 3.99Å; L275-M278 WeakPolarHBondContact O-CB 3.28Å; L275-M278 PolarHBondContact O-N 3.45Å; M278-S280 VanDerWaalsContact C-N 3.26Å; M278-S280 PolarHBondContact O-N 3.4Å; M278-S281 WeakPolarHBondContact O-CB 3.23Å; M278-S281 PolarHBondContact O-N 3.46Å
279	Y	90.7	Very high	88.3	Confident	27 Å²	27	53.4 Å²	53.4	11%	0.106	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-23.3	176.8	-66.2	-58.9	0	0	0	114	Y217 D220 L275 L276 G277 H419	Y217-Y279 AromaticContact CD1-CE2 3.87Å; Y217-Y279 HydrophobicContact CD1-CE2 3.87Å; Y217-Y279 WeakPolarHBondContact CD1-OH 3.43Å; Y217-Y279 AromaticContact CE1-CE2 3.66Å; Y217-Y279 HydrophobicContact CE1-CE2 3.66Å; D220-Y279 WeakPolarHBondContact CB-OH 3.49Å; D220-Y279 PolarHBondContact OD2-OH 3.32Å; L275-Y279 WeakPolarHBondContact O-CD2 3.41Å; L275-Y279 WeakPolarHBondContact O-CE2 3.35Å; L275-Y279 PolarHBondContact O-N 3.11Å; L275-Y279 VanDerWaalsContact O-N 3.17Å; L276-Y279 PolarHBondContact O-N 3.27Å; G277-Y279 VanDerWaalsContact C-N 3.33Å; G277-Y279 PolarHBondContact O-N 2.9Å; Y279-H419 AromaticContact CD1-CE1 3.6Å; Y279-H419 AromaticContact CE1-CE1 3.95Å
280	S	90.5	Very high	87.7	Confident	55 Å²	55	50.9 Å²	50.9	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-85.7	-20.6	-179.6	-58.8	0	0	0	0	112.6	L276 G277 M278	L276-S280 WeakPolarHBondContact O-CB 3.35Å; L276-S280 PolarHBondContact O-N 3.45Å; L276-S280 PolarHBondContact O-OG 2.83Å; G277-S280 PolarHBondContact O-N 2.69Å; M278-S280 VanDerWaalsContact C-N 3.26Å; M278-S280 PolarHBondContact O-N 3.4Å
281	S	85.7	Confident	86.9	Confident	74 Å²	74	52.7 Å²	52.7	52%	0.517	32%	0.317	S	S	.	.	S	Bend	trans	-59.3	144.5	179.7	-65.5	0	0	0	0	113.1	G277 M278	G277-S281 PolarHBondContact O-N 3.45Å; G277-S281 VanDerWaalsContact O-N 3.08Å; G277-S281 PolarHBondContact O-OG 3.27Å; G277-S281 VanDerWaalsContact O-OG 3.1Å; M278-S281 WeakPolarHBondContact O-CB 3.23Å; M278-S281 PolarHBondContact O-N 3.46Å
282	K	82.4	Confident	86.2	Confident	168 Å²	168	59.7 Å²	59.7	73%	0.73	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-73.5	139.7	174.6	-66.8	178.3	-176.8	172.9	0	109.3	V284	K282-V284 PolarHBondContact O-N 3.44Å
283	P	76.6	Confident	85.6	Confident	111 Å²	111	60 Å²	60	72%	0.721	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-63.3	127.3	173.3	27.3	-33.2	0	0	0	109.2
284	V	76.1	Confident	85	Confident	56 Å²	56	59.2 Å²	59.2	34%	0.339	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-100.7	135.2	179.4	-174.2	0	0	0	0	109.5	K282 T286 I289	K282-V284 PolarHBondContact O-N 3.44Å; V284-T286 PolarHBondContact O-N 3.08Å; V284-I289 HydrophobicContact CB-CD1 3.89Å; V284-I289 HydrophobicContact CB-CG1 4.42Å; V284-I289 HydrophobicContact CG1-CD1 3.53Å; V284-I289 HydrophobicContact CG1-CG1 3.52Å
285	S	79.9	Confident	84.3	Confident	66 Å²	66	60.1 Å²	60.1	46%	0.462	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-63.5	125.9	176.3	171.3	0	0	0	0	111	I287 A288 I289	S285-I287 PolarHBondContact O-N 3Å; S285-I287 PolarHBondContact OG-N 3.04Å; S285-A288 PolarHBondContact O-N 3.47Å; S285-A288 VanDerWaalsContact O-N 3.16Å; S285-I289 PolarHBondContact O-N 3.44Å
286	T	80	Confident	83.8	Confident	40 Å²	40	64 Å²	64	25%	0.245	37%	0.365	C	S	.	.	H	α-helix	trans	-60.2	-34.3	178.5	55.1	0	0	0	0	112.5	L68 V284 S290	L68-T286 HydrophobicContact CD1-CG2 3.6Å; L68-T286 HydrophobicContact CD2-CG2 4.31Å; V284-T286 PolarHBondContact O-N 3.08Å; T286-S290 WeakPolarHBondContact O-CB 3.29Å; T286-S290 PolarHBondContact O-N 3.49Å; T286-S290 PolarHBondContact O-OG 2.82Å
287	I	78	Confident	83.1	Confident	82 Å²	82	62.6 Å²	62.6	42%	0.421	36%	0.359	S	S	.	.	H	α-helix	trans	-64.8	-48.2	176	-62.8	174.5	0	0	0	109.9	Q147 S285 I289 S290 S291	Q147-I287 VanDerWaalsContact OE1-CD1 3.24Å; S285-I287 PolarHBondContact O-N 3Å; S285-I287 PolarHBondContact OG-N 3.04Å; I287-I289 VanDerWaalsContact C-N 3.3Å; I287-I289 PolarHBondContact O-N 3.47Å; I287-S290 PolarHBondContact O-N 2.75Å; I287-S291 WeakPolarHBondContact O-CB 3.14Å; I287-S291 PolarHBondContact O-N 3.44Å; I287-S291 PolarHBondContact O-OG 3.03Å
288	A	80	Confident	82.4	Confident	41 Å²	41	66 Å²	66	34%	0.339	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-42.1	-178	0	0	0	0	0	111.5	S285 R292	S285-A288 PolarHBondContact O-N 3.47Å; S285-A288 VanDerWaalsContact O-N 3.16Å; A288-R292 WeakPolarHBondContact O-CG 3.3Å; A288-R292 PolarHBondContact O-N 2.96Å
289	I	82	Confident	81.8	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.036	39%	0.389	C	S	.	.	H	α-helix	trans	-63.3	-48.2	176.3	-64.2	160.8	0	0	0	110.6	T61 N64 L65 V284 S285 I287 S291 R292 L293	T61-I289 HydrophobicContact CG2-CG2 4.5Å; N64-I289 HydrophobicContact CB-CD1 3.78Å; N64-I289 HydrophobicContact CB-CG1 4.27Å; L65-I289 HydrophobicContact CD1-CG2 4.45Å; L65-I289 HydrophobicContact CD2-CG2 3.34Å; L65-I289 HydrophobicContact CG-CG2 3.54Å; V284-I289 HydrophobicContact CB-CD1 3.89Å; V284-I289 HydrophobicContact CB-CG1 4.42Å; V284-I289 HydrophobicContact CG1-CD1 3.53Å; V284-I289 HydrophobicContact CG1-CG1 3.52Å; S285-I289 PolarHBondContact O-N 3.44Å; I287-I289 VanDerWaalsContact C-N 3.3Å; I287-I289 PolarHBondContact O-N 3.47Å; I289-S291 VanDerWaalsContact C-N 3.33Å; I289-S291 PolarHBondContact O-N 3.35Å; I289-R292 PolarHBondContact O-N 3.36Å; I289-L293 PolarHBondContact O-N 2.78Å
290	S	82.5	Confident	81.1	Confident	30 Å²	30	69.1 Å²	69.1	21%	0.21	39%	0.389	C	S	.	.	H	α-helix	trans	-62.3	-40.8	-178.7	-59.3	0	0	0	0	111.7	T286 I287 L293 K294	T286-S290 WeakPolarHBondContact O-CB 3.29Å; T286-S290 PolarHBondContact O-N 3.49Å; T286-S290 PolarHBondContact O-OG 2.82Å; I287-S290 PolarHBondContact O-N 2.75Å; S290-L293 PolarHBondContact O-N 3.33Å; S290-K294 VanDerWaalsContact O-CG 3.31Å; S290-K294 WeakPolarHBondContact O-CG 3.48Å; S290-K294 PolarHBondContact O-N 2.79Å
291	S	79.7	Confident	80.4	Confident	66 Å²	66	70.9 Å²	70.9	46%	0.462	39%	0.39	S	S	.	.	H	α-helix	trans	-65.8	-41.6	176.5	-64.6	0	0	0	0	112.4	I287 I289 L293 K294 A295	I287-S291 WeakPolarHBondContact O-CB 3.14Å; I287-S291 PolarHBondContact O-N 3.44Å; I287-S291 PolarHBondContact O-OG 3.03Å; I289-S291 VanDerWaalsContact C-N 3.33Å; I289-S291 PolarHBondContact O-N 3.35Å; S291-L293 VanDerWaalsContact C-N 3.34Å; S291-K294 PolarHBondContact O-N 2.88Å; S291-A295 WeakPolarHBondContact O-CB 3.48Å; S291-A295 PolarHBondContact O-N 2.59Å
292	R	81.3	Confident	79.9	Confident	148 Å²	148	69.7 Å²	69.7	56%	0.558	39%	0.385	S	S	*	.	H	α-helix	trans	-61.2	-43.5	174.4	-74.5	176.4	-179.1	-171.6	0.5	111.6	T61 A288 I289 A295 R296	T61-R292 HydrophobicContact CG2-CB 4.46Å; A288-R292 WeakPolarHBondContact O-CG 3.3Å; A288-R292 PolarHBondContact O-N 2.96Å; I289-R292 PolarHBondContact O-N 3.36Å; R292-A295 PolarHBondContact O-N 3.39Å; R292-R296 PolarHBondContact O-N 3.27Å
293	L	85.3	Confident	79.6	Confident	12 Å²	12	64.4 Å²	64.4	6%	0.063	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-46	177.7	-176.6	62.8	0	0	0	111.7	L57 L65 F103 V104 F108 I289 S290 S291 A295 R296 S297	L57-L293 HydrophobicContact CD1-CD1 4.26Å; L57-L293 HydrophobicContact CD2-CD1 4.35Å; L65-L293 HydrophobicContact CD1-CD1 4.02Å; L65-L293 HydrophobicContact CD1-CD2 4.12Å; L65-L293 HydrophobicContact CD1-CG 4.46Å; L65-L293 HydrophobicContact CD2-CD2 4Å; F103-L293 HydrophobicContact CB-CD1 3.98Å; V104-L293 HydrophobicContact CG2-CD1 4.29Å; F108-L293 HydrophobicContact CD1-CD2 3.67Å; F108-L293 HydrophobicContact CE1-CD2 4.11Å; I289-L293 PolarHBondContact O-N 2.78Å; S290-L293 PolarHBondContact O-N 3.33Å; S291-L293 VanDerWaalsContact C-N 3.34Å; L293-A295 PolarHBondContact O-N 2.68Å; L293-R296 PolarHBondContact O-N 2.9Å; L293-S297 WeakPolarHBondContact O-CB 3.37Å; L293-S297 PolarHBondContact O-N 3.13Å
294	K	83.6	Confident	79.5	Confident	97 Å²	97	62.6 Å²	62.6	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-48.7	176.9	-74.7	177.1	-177.6	-169	0	112	S290 S291 R296 S297 V298 Y323	S290-K294 VanDerWaalsContact O-CG 3.31Å; S290-K294 WeakPolarHBondContact O-CG 3.48Å; S290-K294 PolarHBondContact O-N 2.79Å; S291-K294 PolarHBondContact O-N 2.88Å; K294-R296 PolarHBondContact O-N 3.4Å; K294-S297 PolarHBondContact O-N 3.15Å; K294-V298 WeakPolarHBondContact O-CG2 3.42Å; K294-V298 PolarHBondContact O-N 3.15Å; K294-Y323 HydrophobicContact CD-CD1 4.3Å; K294-Y323 HydrophobicContact CD-CE1 4.35Å; K294-Y323 VanDerWaalsContact CE-CD1 3.49Å; K294-Y323 HydrophobicContact CG-CE1 4.45Å
295	A	80.4	Confident	79.2	Confident	67 Å²	67	63.3 Å²	63.3	55%	0.554	37%	0.365	S	S	*	.	H	α-helix	trans	-57.7	-40.9	177.8	0	0	0	0	0	111.4	S291 R292 L293 H299	S291-A295 WeakPolarHBondContact O-CB 3.48Å; S291-A295 PolarHBondContact O-N 2.59Å; R292-A295 PolarHBondContact O-N 3.39Å; L293-A295 PolarHBondContact O-N 2.68Å; A295-H299 PolarHBondContact O-N 2.94Å
296	R	84	Confident	78.6	Confident	82 Å²	82	67.7 Å²	67.7	31%	0.309	38%	0.379	S	S	.	.	H	α-helix	trans	-70.9	-39	178.2	-166.2	67.3	-169.4	170.2	3.6	113	D55 G56 L57 V104 R292 L293 K294 H299 C300	D55-R296 VanDerWaalsContact O-CZ 3.25Å; D55-R296 PolarHBondContact O-NE 3.17Å; D55-R296 PolarHBondContact O-NH2 2.68Å; G56-R296 VanDerWaalsContact CA-NH2 3.29Å; G56-R296 PolarHBondContact O-NE 3.28Å; G56-R296 VanDerWaalsContact O-NE 3.15Å; L57-R296 HydrophobicContact CD1-CB 4.45Å; L57-R296 HydrophobicContact CD1-CG 4.45Å; V104-R296 HydrophobicContact CG1-CG 4.29Å; V104-R296 HydrophobicContact CG2-CG 4.04Å; R292-R296 PolarHBondContact O-N 3.27Å; L293-R296 PolarHBondContact O-N 2.9Å; K294-R296 PolarHBondContact O-N 3.4Å; R296-H299 PolarHBondContact O-N 3.41Å; R296-C300 WeakPolarHBondContact O-CB 3.4Å; R296-C300 PolarHBondContact O-N 3.29Å
297	S	80.7	Confident	77.8	Confident	25 Å²	25	71.5 Å²	71.5	18%	0.175	40%	0.398	C	S	.	.	H	α-helix	trans	-60.4	-50.3	177.3	-168.1	0	0	0	0	111.1	V104 L293 K294 H299 C300 F301	V104-S297 PolarHBondContact O-OG 3.28Å; L293-S297 WeakPolarHBondContact O-CB 3.37Å; L293-S297 PolarHBondContact O-N 3.13Å; K294-S297 PolarHBondContact O-N 3.15Å; S297-H299 VanDerWaalsContact C-N 3.32Å; S297-H299 PolarHBondContact O-N 3.35Å; S297-C300 PolarHBondContact O-N 3.29Å; S297-F301 WeakPolarHBondContact O-CD2 3.26Å; S297-F301 PolarHBondContact O-N 3.17Å; S297-F301 WeakPolarHBondContact OG-CE2 3Å
298	V	79.6	Confident	76.4	Confident	107 Å²	107	72 Å²	72	65%	0.648	41%	0.405	S	S	*	.	H	α-helix	trans	-57.6	-44.7	175.9	175.6	0	0	0	0	111.7	K294 A302	K294-V298 WeakPolarHBondContact O-CG2 3.42Å; K294-V298 PolarHBondContact O-N 3.15Å; V298-A302 WeakPolarHBondContact O-CB 3.26Å; V298-A302 PolarHBondContact O-N 3.15Å
299	H	78.4	Confident	74.9	Confident	101 Å²	101	75.3 Å²	75.3	47%	0.468	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-45.1	177.5	-178.8	-75.8	0	0	0	112.2	A295 R296 S297 A302 V303	A295-H299 PolarHBondContact O-N 2.94Å; R296-H299 PolarHBondContact O-N 3.41Å; S297-H299 VanDerWaalsContact C-N 3.32Å; S297-H299 PolarHBondContact O-N 3.35Å; H299-A302 PolarHBondContact O-N 2.97Å; H299-V303 WeakPolarHBondContact O-CG2 3.47Å; H299-V303 PolarHBondContact O-N 3.44Å; H299-V303 VanDerWaalsContact O-N 3.08Å
300	C	76.8	Confident	73.2	Confident	17 Å²	17	82 Å²	82	12%	0.115	46%	0.459	C	S	.	.	H	α-helix	trans	-62.6	-45.7	179.8	-168.4	0	0	0	0	111.4	V104 R296 S297 A302 V303 T304	V104-C300 HydrophobicContact CG1-CB 3.62Å; R296-C300 WeakPolarHBondContact O-CB 3.4Å; R296-C300 PolarHBondContact O-N 3.29Å; S297-C300 PolarHBondContact O-N 3.29Å; C300-A302 VanDerWaalsContact C-N 3.34Å; C300-A302 PolarHBondContact O-N 3.12Å; C300-V303 PolarHBondContact O-N 3.19Å; C300-T304 PolarHBondContact O-N 3.15Å; C300-T304 PolarHBondContact O-OG1 3.44Å
301	F	76.4	Confident	71.5	Confident	91 Å²	91	88.2 Å²	88.2	40%	0.399	49%	0.489	S	S	.	.	H	α-helix	trans	-63.2	-39	177.2	-75.7	-63.5	0	0	0	112.5	S297 T304 A305 D319	S297-F301 WeakPolarHBondContact O-CD2 3.26Å; S297-F301 PolarHBondContact O-N 3.17Å; S297-F301 WeakPolarHBondContact OG-CE2 3Å; F301-T304 PolarHBondContact O-N 3.28Å; F301-A305 WeakPolarHBondContact O-CB 3.49Å; F301-A305 PolarHBondContact O-N 2.92Å; F301-D319 HydrophobicContact CZ-CB 4.47Å
302	A	75.1	Confident	69.6	Low	50 Å²	50	91.5 Å²	91.5	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-41.6	175.7	0	0	0	0	0	112.2	V298 H299 C300 Q306	V298-A302 WeakPolarHBondContact O-CB 3.26Å; V298-A302 PolarHBondContact O-N 3.15Å; H299-A302 PolarHBondContact O-N 2.97Å; C300-A302 VanDerWaalsContact C-N 3.34Å; C300-A302 PolarHBondContact O-N 3.12Å; A302-Q306 WeakPolarHBondContact O-CG 3.39Å; A302-Q306 PolarHBondContact O-N 3.04Å
303	V	75.4	Confident	67.4	Low	57 Å²	57	90.3 Å²	90.3	35%	0.345	50%	0.501	S	S	.	.	H	α-helix	trans	-67.9	-41.5	177.1	174.7	0	0	0	0	111.4	H299 C300 A305 Q306 N307	H299-V303 WeakPolarHBondContact O-CG2 3.47Å; H299-V303 PolarHBondContact O-N 3.44Å; H299-V303 VanDerWaalsContact O-N 3.08Å; C300-V303 PolarHBondContact O-N 3.19Å; V303-A305 PolarHBondContact O-N 2.73Å; V303-Q306 PolarHBondContact O-N 3.05Å; V303-N307 PolarHBondContact O-N 2.94Å; V303-N307 PolarHBondContact O-ND2 3.28Å; V303-N307 VanDerWaalsContact O-ND2 3.16Å
304	T	73.6	Confident	64.9	Low	72 Å²	72	98.7 Å²	98.7	44%	0.442	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-42.5	177.3	-54.5	0	0	0	0	111.5	C300 F301 Q306 N307 T308	C300-T304 PolarHBondContact O-N 3.15Å; C300-T304 PolarHBondContact O-OG1 3.44Å; F301-T304 PolarHBondContact O-N 3.28Å; T304-Q306 VanDerWaalsContact C-N 3.25Å; T304-Q306 PolarHBondContact O-N 2.92Å; T304-N307 PolarHBondContact O-N 3.31Å; T304-N307 VanDerWaalsContact O-N 3.17Å; T304-T308 PolarHBondContact O-N 2.98Å
305	A	69.8	Low	62.6	Low	71 Å²	71	97.9 Å²	97.9	59%	0.587	54%	0.542	S	S	*	.	H	α-helix	trans	-65.1	-26.2	178.8	0	0	0	0	0	113.6	F301 V303 T308	F301-A305 WeakPolarHBondContact O-CB 3.49Å; F301-A305 PolarHBondContact O-N 2.92Å; V303-A305 PolarHBondContact O-N 2.73Å; A305-T308 PolarHBondContact O-OG1 3.46Å
306	Q	67.7	Low	60.5	Low	158 Å²	158	102 Å²	102	74%	0.738	55%	0.55	S	S	*	*	H	α-helix	trans	-80.6	-18.9	176.7	-72.4	175.3	-4.6	0	0	113.4	A302 V303 T304	A302-Q306 WeakPolarHBondContact O-CG 3.39Å; A302-Q306 PolarHBondContact O-N 3.04Å; V303-Q306 PolarHBondContact O-N 3.05Å; T304-Q306 VanDerWaalsContact C-N 3.25Å; T304-Q306 PolarHBondContact O-N 2.92Å
307	N	62.8	Low	58	Low	121 Å²	121	106.5 Å²	106.5	65%	0.647	58%	0.575	S	S	*	*	H	α-helix	trans	-105.9	-4.5	-173.2	-70.3	-33.9	0	0	0	114.1	V303 T304 P309	V303-N307 PolarHBondContact O-N 2.94Å; V303-N307 PolarHBondContact O-ND2 3.28Å; V303-N307 VanDerWaalsContact O-ND2 3.16Å; T304-N307 PolarHBondContact O-N 3.31Å; T304-N307 VanDerWaalsContact O-N 3.17Å; N307-P309 WeakPolarHBondContact O-CD 3.42Å
308	T	49.4	Very low	55.9	Low	93 Å²	93	108.5 Å²	108.5	57%	0.571	58%	0.582	S	S	*	*			trans	-83.6	116.1	175.9	40.8	0	0	0	0	111.1	T304 A305	T304-T308 PolarHBondContact O-N 2.98Å; A305-T308 PolarHBondContact O-OG1 3.46Å
309	P	47.7	Very low	54	Low	109 Å²	109	106.8 Å²	106.8	71%	0.708	57%	0.568	S	S	*	*			trans	-68.2	140.7	168.6	-10.6	27.2	0	0	0	110	N307 D311	N307-P309 WeakPolarHBondContact O-CD 3.42Å; P309-D311 PolarHBondContact O-N 2.91Å
310	D	47.2	Very low	52.1	Low	149 Å²	149	111.1 Å²	111.1	80%	0.797	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-1.8	-171.6	-91.4	-36.5	0	0	0	117.3
311	D	46.3	Very low	50	Low	159 Å²	159	117.6 Å²	117.6	85%	0.85	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	12.2	-167.2	-92.8	-22.6	0	0	0	116.3	P309	P309-D311 PolarHBondContact O-N 2.91Å
312	Q	39.9	Very low	48.1	Very low	136 Å²	136	117.6 Å²	117.6	64%	0.636	62%	0.624	S	S	*	*			trans	-135.2	41.8	175.8	-64.6	-167.9	18.4	0	0	114.7	E314	Q312-E314 VanDerWaalsContact C-N 3.28Å; Q312-E314 PolarHBondContact O-N 3.4Å
313	I	36.1	Very low	46.4	Very low	122 Å²	122	121.6 Å²	121.6	63%	0.626	63%	0.629	S	S	*	*			trans	-79.2	74.1	176.1	-57	176.3	0	0	0	109.8	V315	I313-V315 HydrophobicContact CB-CG2 4.22Å; I313-V315 HydrophobicContact CG1-CG2 4.5Å; I313-V315 HydrophobicContact CG2-CB 3.9Å; I313-V315 HydrophobicContact CG2-CG2 3.42Å; I313-V315 VanDerWaalsContact CG2-CG2 3.42Å
314	E	31.7	Very low	44.5	Very low	188 Å²	188	126 Å²	126	88%	0.879	65%	0.65	S	S	*	*			trans	-90.8	73.1	138.4	-82.8	-172	177.1	0	0	106.1	Q312 E316	Q312-E314 VanDerWaalsContact C-N 3.28Å; Q312-E314 PolarHBondContact O-N 3.4Å; E314-E316 PolarHBondContact O-N 3.13Å
315	V	35.9	Very low	42.7	Very low	80 Å²	80	127 Å²	127	49%	0.485	65%	0.653	S	S	.	*			trans	-72.4	109.4	171.5	170.1	0	0	0	0	106	I313 E317	I313-V315 HydrophobicContact CB-CG2 4.22Å; I313-V315 HydrophobicContact CG1-CG2 4.5Å; I313-V315 HydrophobicContact CG2-CB 3.9Å; I313-V315 HydrophobicContact CG2-CG2 3.42Å; I313-V315 VanDerWaalsContact CG2-CG2 3.42Å; V315-E317 HydrophobicContact CG1-CB 4.41Å; V315-E317 HydrophobicContact CG1-CG 3.85Å; V315-E317 PolarHBondContact O-N 3.16Å
316	E	35.3	Very low	41.5	Very low	153 Å²	153	127.9 Å²	127.9	72%	0.715	65%	0.645	S	S	*	*			trans	-55.1	95.4	148	-74.3	-174.1	164	0	0	105	E314 E318	E314-E316 PolarHBondContact O-N 3.13Å; E316-E318 PolarHBondContact O-N 3.48Å
317	E	32.8	Very low	40.2	Very low	177 Å²	177	126.8 Å²	126.8	83%	0.827	64%	0.644	S	S	*	*			trans	-66.5	70.9	173.8	-74.1	-172.5	150.8	0	0	108.3	V315	V315-E317 HydrophobicContact CG1-CB 4.41Å; V315-E317 HydrophobicContact CG1-CG 3.85Å; V315-E317 PolarHBondContact O-N 3.16Å
318	E	36.9	Very low	39	Very low	68 Å²	68	128.6 Å²	128.6	32%	0.318	65%	0.646	S	S	.	*			trans	-128.4	126.8	176.7	-58.5	-156	144.3	0	0	107.8	K173 E316	K173-E318 VanDerWaalsContact CD-OE1 3.3Å; K173-E318 WeakPolarHBondContact CD-OE1 3.25Å; K173-E318 WeakPolarHBondContact CE-OE1 3.46Å; K173-E318 IonicContact NZ-OE1 2.59Å; K173-E318 PolarHBondContact NZ-OE1 3.04Å; E316-E318 PolarHBondContact O-N 3.48Å
319	D	39.6	Very low	38.2	Very low	70 Å²	70	132.4 Å²	132.4	37%	0.374	66%	0.662	S	S	.	*	S	Bend	trans	92	30	175.1	-51.3	-34.2	0	0	0	118.7	R177 F301	R177-D319 IonicContact NH1-OD2 3.44Å; F301-D319 HydrophobicContact CZ-CB 4.47Å
320	K	38.4	Very low	37.6	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.835	66%	0.663	S	S	*	*			trans	-92.1	-13.2	169.4	-85.8	-176	-179.9	172.9	0	116.5
321	D	32.5	Very low	37	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	67%	0.667	S	S	*	*	S	Bend	trans	-126	134.4	-174.1	-62.9	-44	0	0	0	112.5
322	D	36	Very low	36.3	Very low	90 Å²	90	128.7 Å²	128.7	48%	0.481	67%	0.669	S	S	.	*			trans	98.7	61.5	162.5	-131.9	16	0	0	0	118.6
323	Y	39.1	Very low	36.2	Very low	135 Å²	135	131.3 Å²	131.3	53%	0.529	68%	0.68	S	S	.	*			trans	-125.6	53.7	147.7	-87.2	-72	0	0	0	110.5	N107 K294 D325	N107-Y323 PolarHBondContact ND2-OH 3.42Å; N107-Y323 VanDerWaalsContact ND2-OH 3.13Å; K294-Y323 HydrophobicContact CD-CD1 4.3Å; K294-Y323 HydrophobicContact CD-CE1 4.35Å; K294-Y323 VanDerWaalsContact CE-CD1 3.49Å; K294-Y323 HydrophobicContact CG-CE1 4.45Å; Y323-D325 PolarHBondContact O-N 3.39Å
324	L	36.2	Very low	35.9	Very low	150 Å²	150	131.2 Å²	131.2	79%	0.785	69%	0.69	S	S	*	*			trans	-85.3	111	169.1	-71	175.7	0	0	0	110.8	E326	L324-E326 PolarHBondContact O-N 3.37Å
325	D	35.8	Very low	36.1	Very low	93 Å²	93	126.2 Å²	126.2	50%	0.497	69%	0.689	S	S	.	*			trans	-6.9	94.7	153.7	-142.6	1.8	0	0	0	115.2	Y323 D327 K328	Y323-D325 PolarHBondContact O-N 3.39Å; D325-D327 PolarHBondContact O-N 3.42Å; D325-K328 WeakPolarHBondContact OD2-CD 3.24Å; D325-K328 VanDerWaalsContact OD2-CE 3.24Å; D325-K328 WeakPolarHBondContact OD2-CE 3.46Å; D325-K328 IonicContact OD2-NZ 2.96Å; D325-K328 PolarHBondContact OD2-NZ 3.45Å
326	E	43.8	Very low	35.9	Very low	89 Å²	89	131.9 Å²	131.9	42%	0.416	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-5.4	175.4	-82.1	-152.8	147.7	0	0	113.8	R144 R163 L324	R144-E326 IonicContact CZ-OE2 3.61Å; R144-E326 IonicContact NH1-OE2 3.61Å; R144-E326 IonicContact NH2-OE2 2.73Å; R144-E326 PolarHBondContact NH2-OE2 2.9Å; R163-E326 IonicContact CZ-OE1 3.23Å; R163-E326 VanDerWaalsContact CZ-OE1 3.23Å; R163-E326 IonicContact NH1-OE1 2.77Å; R163-E326 PolarHBondContact NH1-OE1 2.88Å; R163-E326 IonicContact NH2-OE1 2.77Å; R163-E326 PolarHBondContact NH2-OE1 3.19Å; L324-E326 PolarHBondContact O-N 3.37Å
327	D	39.6	Very low	35.9	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	1.6	-173.6	-72.3	-29.2	0	0	0	114.4	D325	D325-D327 PolarHBondContact O-N 3.42Å
328	K	37.6	Very low	36	Very low	159 Å²	159	132.9 Å²	132.9	69%	0.691	71%	0.711	S	S	*	*	S	Bend	trans	-105.3	-0.5	-177.7	-72.5	-174.7	-177.6	167.8	0	116.8	D325	D325-K328 WeakPolarHBondContact OD2-CD 3.24Å; D325-K328 VanDerWaalsContact OD2-CE 3.24Å; D325-K328 WeakPolarHBondContact OD2-CE 3.46Å; D325-K328 IonicContact OD2-NZ 2.96Å; D325-K328 PolarHBondContact OD2-NZ 3.45Å
329	L	34	Very low	36	Very low	173 Å²	173	135.7 Å²	135.7	91%	0.906	74%	0.738	S	S	*	*	S	Bend	trans	-109.4	16	-176.1	-69.3	173.1	0	0	0	115.3
330	A	35.8	Very low	35.7	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	76%	0.761	S	S	*	*	S	Bend	trans	-105.5	-0.4	-179.6	0	0	0	0	0	115.8
331	N	34	Very low	35.5	Very low	166 Å²	166	131.1 Å²	131.1	89%	0.888	76%	0.762	S	S	*	*			trans	-135.8	107	-179.6	-83.9	-19.8	0	0	0	111.4
332	G	31.3	Very low	35.6	Very low	86 Å²	86	132.5 Å²	132.5	89%	0.887	76%	0.764	S	S	*	*			trans	-171.5	62.5	177.6	0	0	0	0	0	112.7
333	H	37	Very low	35.7	Very low	190 Å²	190	136 Å²	136	88%	0.88	78%	0.781	S	S	*	*			trans	-84	138.7	175.3	-144.1	56.9	0	0	0	110.3
334	S	31.7	Very low	35.6	Very low	120 Å²	120	134.4 Å²	134.4	84%	0.839	79%	0.79	S	S	*	*			trans	65	112.8	150.6	-161.7	0	0	0	0	119.5
335	G	34.9	Very low	35.4	Very low	83 Å²	83	133 Å²	133	86%	0.856	79%	0.79	S	S	*	*			trans	-168.8	84.9	168.9	0	0	0	0	0	112.8
336	K	32.6	Very low	35.5	Very low	200 Å²	200	135.7 Å²	135.7	87%	0.87	81%	0.809	S	S	*	*			trans	-90.1	132.4	179	-170.3	179.6	-168.6	177	0	109.7
337	R	35.1	Very low	35	Very low	227 Å²	227	139.4 Å²	139.4	86%	0.857	83%	0.826	S	S	*	*			trans	150.4	114.3	149.3	-87.6	167.4	-177.6	-158.6	0.5	110.9
338	T	33.4	Very low	34.7	Very low	123 Å²	123	138.5 Å²	138.5	76%	0.755	83%	0.826	S	S	*	*				110.5	142.7	65.5	44.1	0	0	0	0	111.1
339	S	37.8	Very low	34.6	Very low	128 Å²	128	142.2 Å²	142.2	90%	0.895	84%	0.836	S	S	*	*			trans	70.7	133.6	171.6	70	0	0	0	0	116.1
340	G	32.5	Very low	34.7	Very low	83 Å²	83	138.9 Å²	138.9	86%	0.856	82%	0.824	S	S	*	*			cis	157	138.2	8.2	0	0	0	0	0	106.3
341	G	35.6	Very low	34.6	Very low	82 Å²	82	141.7 Å²	141.7	85%	0.845	83%	0.827	S	S	*	*			trans	155.1	105.6	177.6	0	0	0	0	0	113
342	E	33.1	Very low	34.8	Very low	184 Å²	184	143.6 Å²	143.6	86%	0.86	83%	0.828	S	S	*	*			trans	-80.7	177	-170.1	-69.7	170	115.9	0	0	115.5
343	L	39	Very low	34.9	Very low	163 Å²	163	147 Å²	147	85%	0.853	83%	0.825	S	S	*	*			trans	98.7	127.1	158.9	-52.2	168.3	0	0	0	115
344	S	37.9	Very low	35.1	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	82%	0.824	S	S	*	*			cis	-168.7	153.7	-11.9	-88.4	0	0	0	0	106.4
345	P	31.6	Very low	35	Very low	121 Å²	121	149.4 Å²	149.4	79%	0.786	82%	0.823	S	S	*	*			trans	-102.1	145.1	-174.5	34	-23.3	0	0	0	113
346	V	38.1	Very low	35.2	Very low	149 Å²	149	150 Å²	150	90%	0.903	81%	0.814	S	S	*	*			trans	-127.8	122.8	166.9	178.3	0	0	0	0	110.4
347	Q	33.7	Very low	35.5	Very low	167 Å²	167	148 Å²	148	78%	0.78	81%	0.812	S	S	*	*			trans	-89.5	165	178.4	-66.9	176.6	-16.7	0	0	112.2
348	T	33	Very low	35.6	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	81%	0.811	S	S	*	*			trans	84.7	114.6	144.1	6.4	0	0	0	0	119.2
349	R	35.5	Very low	36	Very low	236 Å²	236	143.1 Å²	143.1	89%	0.891	82%	0.815	S	S	*	*				-177.9	150.1	92.5	-91.8	175.3	-174.1	-161.1	1	112.5
350	P	35.7	Very low	35.8	Very low	103 Å²	103	143.7 Å²	143.7	67%	0.669	81%	0.813	S	S	*	*			trans	-102.4	176.6	-177.8	39.7	-32	0	0	0	113.9
351	N	34.4	Very low	36.4	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	81%	0.811	S	S	*	*			trans	88.6	114.1	166.3	-55.9	-22.7	0	0	0	117.4
352	K	37.7	Very low	36.4	Very low	205 Å²	205	148.8 Å²	148.8	89%	0.891	81%	0.805	S	S	*	*				178.5	142.3	94.4	-96.4	178.4	179	178.4	0	112.3
353	L	33.4	Very low	36.7	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	81%	0.811	S	S	*	*			trans	-44.8	141.3	167.8	-68.1	133	0	0	0	114.1
354	H	40.6	Very low	36.7	Very low	189 Å²	189	150 Å²	150	88%	0.875	80%	0.803	S	S	*	*			trans	-157.9	116.8	135.1	-128.6	-82.4	0	0	0	111.3
355	E	30.6	Very low	36.7	Very low	172 Å²	172	154 Å²	154	80%	0.804	81%	0.811	S	S	*	*			trans	-59.3	142.8	158.5	-81	167.5	114.6	0	0	109.9
356	S	38.4	Very low	37.1	Very low	96 Å²	96	156.4 Å²	156.4	67%	0.671	81%	0.809	S	S	*	*				170	137	115.9	45.8	0	0	0	0	113.6
357	N	38.2	Very low	37.3	Very low	157 Å²	157	157.2 Å²	157.2	84%	0.84	80%	0.803	S	S	*	*			trans	78.2	101.3	143.1	-58.5	-14.3	0	0	0	120.9
358	S	38.3	Very low	37.4	Very low	119 Å²	119	155.4 Å²	155.4	83%	0.832	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-94.2	142.2	148.6	-66.4	0	0	0	0	110.5
359	P	41.6	Very low	37.9	Very low	129 Å²	129	154.7 Å²	154.7	84%	0.838	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-92.3	136.7	165.8	20.7	-5.1	0	0	0	111.6
360	V	34	Very low	38.2	Very low	140 Å²	140	148.1 Å²	148.1	85%	0.848	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90.7	139	172.6	174.7	0	0	0	0	108.6
361	S	44.8	Very low	38.5	Very low	115 Å²	115	151.6 Å²	151.6	80%	0.804	80%	0.801	S	S	*	*			trans	-113.3	123.4	164.4	61.6	0	0	0	0	110.6
362	E	34.1	Very low	38.9	Very low	158 Å²	158	154 Å²	154	74%	0.738	80%	0.804	S	S	*	*			trans	-56.3	149.8	173.1	-73.7	166.8	122.9	0	0	113.9
363	F	41	Very low	39.2	Very low	223 Å²	223	149 Å²	149	98%	0.978	79%	0.793	S	S	*	*				-152.7	137.9	126.7	-103.3	-77.1	0	0	0	110
364	H	38.4	Very low	39.6	Very low	149 Å²	149	150.3 Å²	150.3	69%	0.69	79%	0.792	S	S	*	*			trans	-112.1	139	-160.1	-133.8	-68.8	0	0	0	110.2
365	E	38.8	Very low	39.6	Very low	185 Å²	185	149.5 Å²	149.5	86%	0.864	79%	0.788	S	S	*	*			trans	-173.9	105.1	142.5	-111.8	177.8	149.4	0	0	109.5
366	K	38.8	Very low	40	Very low	172 Å²	172	151 Å²	151	75%	0.748	79%	0.792	S	S	*	*				54.9	118.7	94.5	-87.6	-178.1	-177	177.8	0	112.1
367	Q	41.6	Very low	40	Very low	166 Å²	166	156.5 Å²	156.5	78%	0.776	80%	0.798	S	S	*	*			cis	-163.6	139.1	46.7	-103.6	165.9	17.8	0	0	112.1
368	T	36.9	Very low	40.2	Very low	128 Å²	128	155.6 Å²	155.6	79%	0.785	79%	0.788	S	S	*	*			trans	30.6	141.2	133.1	68	0	0	0	0	120.4
369	S	42.5	Very low	40.3	Very low	102 Å²	102	158.9 Å²	158.9	71%	0.713	78%	0.783	S	S	*	*			cis	-165.1	150.1	33.2	51.8	0	0	0	0	112.9
370	S	43.3	Very low	40.1	Very low	98 Å²	98	162.9 Å²	162.9	69%	0.685	78%	0.781	S	S	*	*			trans	44.7	138.2	140.9	59.5	0	0	0	0	121
371	E	40.3	Very low	40.3	Very low	176 Å²	176	161.9 Å²	161.9	82%	0.822	78%	0.78	S	S	*	*			cis	-172.9	120.2	6.6	-104.7	172.1	163.7	0	0	104.3
372	K	43.4	Very low	39.7	Very low	199 Å²	199	160.5 Å²	160.5	87%	0.865	78%	0.784	S	S	*	*				73.9	152.4	96.7	-92.2	-164	-176.4	174.1	0	117
373	P	44.7	Very low	39.9	Very low	100 Å²	100	156.5 Å²	156.5	65%	0.649	79%	0.785	S	S	*	*				-133.7	-168.7	-123.2	35.3	-12.9	0	0	0	113.2
374	K	42	Very low	39.6	Very low	184 Å²	184	158 Å²	158	80%	0.8	78%	0.784	S	S	*	*				160.3	127.2	127.5	-84.4	162.3	-175	-179.1	0	114.5
375	H	39.2	Very low	40	Very low	172 Å²	172	155.9 Å²	155.9	80%	0.796	79%	0.787	S	S	*	*			trans	12.7	135.9	140.3	-53.9	-81.8	0	0	0	121.2
376	K	40.8	Very low	40.1	Very low	203 Å²	203	154.8 Å²	154.8	88%	0.883	78%	0.781	S	S	*	*				173.8	133.3	94.8	-95.7	178.5	-179.7	172	0	113.2
377	R	36.8	Very low	39.9	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	78%	0.784	S	S	*	*			trans	-15.6	138.8	154.4	-57.2	169.5	164.6	-178.3	-4.8	117.5
378	H	42.7	Very low	39.6	Very low	138 Å²	138	152.9 Å²	152.9	64%	0.639	79%	0.786	S	S	*	*				168.1	130.8	93.7	-96.5	-67	0	0	0	114.1
379	R	40	Very low	39.7	Very low	189 Å²	189	151.4 Å²	151.4	71%	0.713	78%	0.781	S	S	*	*			trans	58.3	128	133.9	-75.1	179.8	177.4	-178.2	0.7	122.8
380	R	37.4	Very low	39.6	Very low	213 Å²	213	157.3 Å²	157.3	80%	0.804	79%	0.79	S	S	*	*			trans	71.2	138.3	140.7	-66.6	173.7	177.2	179.8	-3.2	114.4
381	S	38.8	Very low	39.7	Very low	118 Å²	118	162.1 Å²	162.1	83%	0.825	80%	0.798	S	S	*	*			cis	-177.4	153.4	8.4	35.2	0	0	0	0	106.7
382	G	32.8	Very low	39.9	Very low	86 Å²	86	159.4 Å²	159.4	89%	0.887	79%	0.785	S	S	*	*			trans	110.7	126.2	157	0	0	0	0	0	114.6
383	G	37.6	Very low	40.1	Very low	75 Å²	75	153.8 Å²	153.8	77%	0.773	77%	0.771	S	S	*	*			trans	149.8	74.1	172.3	0	0	0	0	0	113
384	R	35.5	Very low	40.2	Very low	253 Å²	253	154 Å²	154	96%	0.955	77%	0.767	S	S	*	*			trans	-63.2	125.3	163.7	-81.7	172.3	163.6	172.1	-5.3	109.2
385	S	46.1	Very low	40.5	Very low	106 Å²	106	154.1 Å²	154.1	74%	0.741	76%	0.762	S	S	*	*			trans	-163.9	117.6	149	34.8	0	0	0	0	113
386	H	41.2	Very low	41.1	Very low	161 Å²	161	149.9 Å²	149.9	75%	0.745	75%	0.745	S	S	*	*			trans	64.6	90.3	143.6	-91.5	67.7	0	0	0	119.6
387	G	35.2	Very low	41.6	Very low	78 Å²	78	146.8 Å²	146.8	80%	0.804	73%	0.734	S	S	*	*			trans	-74.3	121.7	148.1	0	0	0	0	0	110.4
388	R	34.6	Very low	42.4	Very low	220 Å²	220	143.6 Å²	143.6	83%	0.83	73%	0.728	S	S	*	*			trans	-163.9	140.6	160.1	-102.5	167.5	-168.6	-163.1	3	107.7
389	S	38.8	Very low	43.1	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	72%	0.722	S	S	*	*			trans	87.6	77.4	169.6	-172.1	0	0	0	0	119.1
390	Y	41	Very low	44.2	Very low	227 Å²	227	135.6 Å²	135.6	89%	0.89	71%	0.71	S	S	*	*	S	Bend	trans	-128.3	15.8	155	-77.8	-75.5	0	0	0	113.5
391	K	45.2	Very low	45.2	Very low	198 Å²	198	131.5 Å²	131.5	86%	0.861	69%	0.694	S	S	*	*	S	Bend	trans	-111.2	-4	-177.7	-82.3	-174.1	175	-179.4	0	115.5
392	H	44.4	Very low	46.4	Very low	120 Å²	120	131.5 Å²	131.5	56%	0.556	68%	0.681	S	S	*	*	S	Bend	trans	-92.3	-27.9	-176.3	-135.1	-62.4	0	0	0	114.4	N394 R395 D396	H392-N394 PolarHBondContact O-N 3.03Å; H392-R395 PolarHBondContact O-N 3.21Å; H392-D396 IonicContact ND1-OD2 3.56Å
393	S	47.6	Very low	47.9	Very low	80 Å²	80	134.5 Å²	134.5	56%	0.559	67%	0.67	S	S	*	*	H	α-helix	trans	-68.9	-36.4	-174.6	66.6	0	0	0	0	114.3	R395 D396 E397	S393-R395 VanDerWaalsContact C-N 3.29Å; S393-R395 PolarHBondContact O-N 2.94Å; S393-D396 PolarHBondContact O-N 3.46Å; S393-E397 PolarHBondContact O-N 3.41Å
394	N	46.8	Very low	48.9	Very low	106 Å²	106	136.6 Å²	136.6	57%	0.567	65%	0.654	S	S	*	*	H	α-helix	trans	-69.7	-26.9	-180	-79.9	-15	0	0	0	112.9	H392 Q398	H392-N394 PolarHBondContact O-N 3.03Å; N394-Q398 PolarHBondContact O-N 2.91Å
395	R	47.4	Very low	50.1	Low	186 Å²	186	126.6 Å²	126.6	70%	0.702	62%	0.619	S	S	*	*	H	α-helix	trans	-75	-36.3	-179.7	-146.2	179.1	-172.9	-173.4	0.8	111	H392 S393 S399	H392-R395 PolarHBondContact O-N 3.21Å; S393-R395 VanDerWaalsContact C-N 3.29Å; S393-R395 PolarHBondContact O-N 2.94Å; R395-S399 WeakPolarHBondContact O-CB 3.47Å; R395-S399 PolarHBondContact O-N 3.02Å
396	D	52.6	Low	50.9	Low	82 Å²	82	126 Å²	126	44%	0.439	60%	0.604	S	S	.	*	H	α-helix	trans	-72	-35.4	176.8	-61.7	-33.4	0	0	0	111.8	H392 S393 N400	H392-D396 IonicContact ND1-OD2 3.56Å; S393-D396 PolarHBondContact O-N 3.46Å; D396-N400 WeakPolarHBondContact O-CB 3.42Å; D396-N400 VanDerWaalsContact O-CG 3.29Å; D396-N400 PolarHBondContact O-N 3.27Å; D396-N400 PolarHBondContact O-ND2 3.03Å
397	E	51.1	Low	51.9	Low	139 Å²	139	123.7 Å²	123.7	65%	0.65	59%	0.594	S	S	*	*	H	α-helix	trans	-66.1	-43.4	172.8	-98.9	-171.1	156	0	0	113	S393 N400 R401	S393-E397 PolarHBondContact O-N 3.41Å; E397-N400 PolarHBondContact O-N 3.43Å; E397-R401 WeakPolarHBondContact O-CB 3.35Å; E397-R401 PolarHBondContact O-N 3.39Å
398	Q	53.7	Low	53	Low	143 Å²	143	120.8 Å²	120.8	67%	0.668	56%	0.56	S	S	*	*	H	α-helix	trans	-65.9	-41.5	176.3	-86.1	-178.3	-21.2	0	0	112.3	N394 R401 H402	N394-Q398 PolarHBondContact O-N 2.91Å; Q398-R401 PolarHBondContact O-N 2.88Å; Q398-H402 PolarHBondContact O-N 2.99Å
399	S	57.2	Low	54.1	Low	74 Å²	74	115.1 Å²	115.1	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-59.7	-46.4	174.6	177.2	0	0	0	0	111.5	R395 R401 H402 K403	R395-S399 WeakPolarHBondContact O-CB 3.47Å; R395-S399 PolarHBondContact O-N 3.02Å; S399-R401 VanDerWaalsContact C-N 3.32Å; S399-R401 PolarHBondContact O-N 3.31Å; S399-H402 PolarHBondContact O-N 3.47Å; S399-K403 WeakPolarHBondContact O-CB 3.49Å; S399-K403 PolarHBondContact O-N 3.27Å
400	N	62.8	Low	55.3	Low	85 Å²	85	114.3 Å²	114.3	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-34.6	176.7	-79.7	-43.7	0	0	0	112.9	D396 E397 R404	D396-N400 WeakPolarHBondContact O-CB 3.42Å; D396-N400 VanDerWaalsContact O-CG 3.29Å; D396-N400 PolarHBondContact O-N 3.27Å; D396-N400 PolarHBondContact O-ND2 3.03Å; E397-N400 PolarHBondContact O-N 3.43Å; N400-R404 WeakPolarHBondContact O-CG 3.46Å; N400-R404 PolarHBondContact O-N 3.35Å; N400-R404 VanDerWaalsContact O-N 3.16Å
401	R	59	Low	56.1	Low	127 Å²	127	105.7 Å²	105.7	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-67.7	-46.9	175	-177.1	179.8	175.6	164.5	5.8	111.5	E397 Q398 S399 K403 R404 E405	E397-R401 WeakPolarHBondContact O-CB 3.35Å; E397-R401 PolarHBondContact O-N 3.39Å; Q398-R401 PolarHBondContact O-N 2.88Å; S399-R401 VanDerWaalsContact C-N 3.32Å; S399-R401 PolarHBondContact O-N 3.31Å; R401-K403 VanDerWaalsContact C-N 3.31Å; R401-K403 PolarHBondContact O-N 2.94Å; R401-R404 WeakPolarHBondContact O-CB 3.48Å; R401-R404 PolarHBondContact O-N 3.28Å; R401-R404 VanDerWaalsContact O-N 3.13Å; R401-E405 IonicContact CZ-OE1 3.79Å; R401-E405 IonicContact NE-OE1 2.97Å; R401-E405 PolarHBondContact NE-OE1 3.13Å; R401-E405 IonicContact NH2-OE1 3.75Å; R401-E405 PolarHBondContact O-N 2.9Å
402	H	62.9	Low	56.3	Low	118 Å²	118	97.4 Å²	97.4	55%	0.546	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-41.2	179.5	-152.8	-73	0	0	0	111.3	Q398 S399 R404 E405 E406	Q398-H402 PolarHBondContact O-N 2.99Å; S399-H402 PolarHBondContact O-N 3.47Å; H402-R404 VanDerWaalsContact C-N 3.31Å; H402-R404 PolarHBondContact O-N 2.89Å; H402-E405 PolarHBondContact O-N 2.82Å; H402-E406 WeakPolarHBondContact O-CB 3.46Å; H402-E406 PolarHBondContact O-N 2.77Å
403	K	65	Low	56.7	Low	149 Å²	149	97.2 Å²	97.2	65%	0.648	46%	0.46	S	S	*	.	H	α-helix	trans	-62.6	-34.8	174.9	-165.1	174.1	-178	178.7	0	112.7	S399 R401 E407	S399-K403 WeakPolarHBondContact O-CB 3.49Å; S399-K403 PolarHBondContact O-N 3.27Å; R401-K403 VanDerWaalsContact C-N 3.31Å; R401-K403 PolarHBondContact O-N 2.94Å; K403-E407 WeakPolarHBondContact O-CB 3.45Å; K403-E407 PolarHBondContact O-N 2.9Å
404	R	58.9	Low	56.9	Low	119 Å²	119	97.2 Å²	97.2	45%	0.449	45%	0.454	S	S	.	.	H	α-helix	trans	-71.4	-43.2	174.5	-72.5	169.6	-163.5	-167.6	6.3	112.5	R81 N400 R401 H402 E406 E407 V408	R81-R404 VanDerWaalsContact NH2-NE 3.18Å; R81-R404 VanDerWaalsContact NH2-NH2 3.18Å; N400-R404 WeakPolarHBondContact O-CG 3.46Å; N400-R404 PolarHBondContact O-N 3.35Å; N400-R404 VanDerWaalsContact O-N 3.16Å; R401-R404 WeakPolarHBondContact O-CB 3.48Å; R401-R404 PolarHBondContact O-N 3.28Å; R401-R404 VanDerWaalsContact O-N 3.13Å; H402-R404 VanDerWaalsContact C-N 3.31Å; H402-R404 PolarHBondContact O-N 2.89Å; R404-E406 VanDerWaalsContact C-N 3.25Å; R404-E406 PolarHBondContact O-N 2.77Å; R404-E407 PolarHBondContact O-N 3.16Å; R404-V408 VanDerWaalsContact O-CG2 3.24Å; R404-V408 WeakPolarHBondContact O-CG2 3.24Å; R404-V408 PolarHBondContact O-N 3.03Å
405	E	59.7	Low	56.8	Low	44 Å²	44	95.3 Å²	95.3	21%	0.206	44%	0.44	C	S	.	.	H	α-helix	trans	-62.5	-38.5	176.7	-72.5	174.3	-172.1	0	0	110.2	R401 H402 R409	R401-E405 IonicContact CZ-OE1 3.79Å; R401-E405 IonicContact NE-OE1 2.97Å; R401-E405 PolarHBondContact NE-OE1 3.13Å; R401-E405 IonicContact NH2-OE1 3.75Å; R401-E405 PolarHBondContact O-N 2.9Å; H402-E405 PolarHBondContact O-N 2.82Å; E405-R409 VanDerWaalsContact O-CB 3.26Å; E405-R409 WeakPolarHBondContact O-CB 3.34Å; E405-R409 PolarHBondContact O-N 2.79Å
406	E	63.1	Low	56.6	Low	93 Å²	93	92.1 Å²	92.1	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-69	-40.4	173.2	-167.2	172.5	-172.8	0	0	112.7	H402 R404 R409 N410	H402-E406 WeakPolarHBondContact O-CB 3.46Å; H402-E406 PolarHBondContact O-N 2.77Å; R404-E406 VanDerWaalsContact C-N 3.25Å; R404-E406 PolarHBondContact O-N 2.77Å; E406-R409 PolarHBondContact O-N 2.97Å; E406-N410 WeakPolarHBondContact O-CB 3.38Å; E406-N410 PolarHBondContact O-N 3.43Å; E406-N410 PolarHBondContact O-ND2 2.96Å
407	E	62.2	Low	55.8	Low	113 Å²	113	89.8 Å²	89.8	53%	0.528	42%	0.424	S	S	.	.	H	α-helix	trans	-62.7	-42.8	174.2	-172.4	176.7	-172.2	0	0	111.9	K403 R404 N410 I411	K403-E407 WeakPolarHBondContact O-CB 3.45Å; K403-E407 PolarHBondContact O-N 2.9Å; R404-E407 PolarHBondContact O-N 3.16Å; E407-N410 PolarHBondContact O-N 2.97Å; E407-I411 HydrophobicContact CG-CD1 4.03Å; E407-I411 WeakPolarHBondContact O-CB 3.43Å; E407-I411 WeakPolarHBondContact O-CD1 3.2Å; E407-I411 WeakPolarHBondContact O-CG1 3.34Å; E407-I411 PolarHBondContact O-N 3.43Å
408	V	58.5	Low	55.3	Low	16 Å²	16	89.6 Å²	89.6	10%	0.097	42%	0.418	C	S	.	.	H	α-helix	trans	-65.3	-45.3	175.1	173.5	0	0	0	0	110.6	L79 L142 R404 N410 I411 L412	L79-V408 HydrophobicContact CD2-CG2 3.52Å; L79-V408 HydrophobicContact CG-CG2 4.46Å; L142-V408 HydrophobicContact CD1-CG1 4.32Å; R404-V408 VanDerWaalsContact O-CG2 3.24Å; R404-V408 WeakPolarHBondContact O-CG2 3.24Å; R404-V408 PolarHBondContact O-N 3.03Å; V408-N410 VanDerWaalsContact C-N 3.34Å; V408-N410 PolarHBondContact O-N 3.4Å; V408-I411 PolarHBondContact O-N 3Å; V408-L412 HydrophobicContact CG1-CD1 3.97Å; V408-L412 HydrophobicContact CG1-CG 4.48Å; V408-L412 WeakPolarHBondContact O-CB 3.45Å; V408-L412 VanDerWaalsContact O-CG 3.27Å; V408-L412 WeakPolarHBondContact O-CG 3.28Å; V408-L412 PolarHBondContact O-N 3.02Å
409	R	58.6	Low	54.7	Low	101 Å²	101	86 Å²	86	38%	0.381	40%	0.401	S	S	.	.	H	α-helix	trans	-60	-44.9	175.7	-168.1	-175.2	-65.7	126.4	-1	110.7	E405 E406 I411 L412 E413	E405-R409 VanDerWaalsContact O-CB 3.26Å; E405-R409 WeakPolarHBondContact O-CB 3.34Å; E405-R409 PolarHBondContact O-N 2.79Å; E406-R409 PolarHBondContact O-N 2.97Å; R409-I411 PolarHBondContact O-N 2.95Å; R409-L412 CarbonylContact O-C 3.59Å; R409-L412 PolarHBondContact O-N 3.32Å; R409-E413 WeakPolarHBondContact CD-OE1 3.46Å; R409-E413 HydrophobicContact CG-CG 4.28Å; R409-E413 WeakPolarHBondContact CG-OE1 3.33Å; R409-E413 VanDerWaalsContact O-CB 3.32Å; R409-E413 WeakPolarHBondContact O-CB 3.34Å; R409-E413 WeakPolarHBondContact O-CG 3.39Å; R409-E413 PolarHBondContact O-N 3.27Å
410	N	63.3	Low	53.6	Low	80 Å²	80	89.4 Å²	89.4	43%	0.428	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-38.1	176.3	-71	-18.4	0	0	0	111.9	E406 E407 V408 L412 D414	E406-N410 WeakPolarHBondContact O-CB 3.38Å; E406-N410 PolarHBondContact O-N 3.43Å; E406-N410 PolarHBondContact O-ND2 2.96Å; E407-N410 PolarHBondContact O-N 2.97Å; V408-N410 VanDerWaalsContact C-N 3.34Å; V408-N410 PolarHBondContact O-N 3.4Å; N410-L412 VanDerWaalsContact C-N 3.34Å; N410-D414 WeakPolarHBondContact O-CA 3.44Å; N410-D414 WeakPolarHBondContact O-CB 3.34Å; N410-D414 PolarHBondContact O-N 3.07Å
411	I	57.8	Low	52.3	Low	47 Å²	47	93 Å²	93	24%	0.241	42%	0.42	C	S	.	.	H	α-helix	trans	-67.2	-37.3	175.4	-71.1	164.1	0	0	0	111	I78 E407 V408 R409 K415	I78-I411 HydrophobicContact CD1-CD1 4.18Å; I78-I411 HydrophobicContact CD1-CG2 4.09Å; I78-I411 HydrophobicContact CG2-CD1 4.02Å; E407-I411 HydrophobicContact CG-CD1 4.03Å; E407-I411 WeakPolarHBondContact O-CB 3.43Å; E407-I411 WeakPolarHBondContact O-CD1 3.2Å; E407-I411 WeakPolarHBondContact O-CG1 3.34Å; E407-I411 PolarHBondContact O-N 3.43Å; V408-I411 PolarHBondContact O-N 3Å; R409-I411 PolarHBondContact O-N 2.95Å; I411-K415 HydrophobicContact CG2-CD 4.32Å; I411-K415 VanDerWaalsContact O-CB 3.32Å; I411-K415 WeakPolarHBondContact O-CB 3.48Å; I411-K415 VanDerWaalsContact O-CG 3.28Å; I411-K415 WeakPolarHBondContact O-CG 3.33Å; I411-K415 PolarHBondContact O-N 3.46Å
412	L	49.6	Very low	51.3	Low	24 Å²	24	88.7 Å²	88.7	13%	0.126	41%	0.409	C	S	.	.	H	α-helix	trans	-68.5	-51.4	174.5	-68.1	168.4	0	0	0	110	V408 R409 N410 D414 K415 Y416	V408-L412 HydrophobicContact CG1-CD1 3.97Å; V408-L412 HydrophobicContact CG1-CG 4.48Å; V408-L412 WeakPolarHBondContact O-CB 3.45Å; V408-L412 VanDerWaalsContact O-CG 3.27Å; V408-L412 WeakPolarHBondContact O-CG 3.28Å; V408-L412 PolarHBondContact O-N 3.02Å; R409-L412 CarbonylContact O-C 3.59Å; R409-L412 PolarHBondContact O-N 3.32Å; N410-L412 VanDerWaalsContact C-N 3.34Å; L412-D414 PolarHBondContact O-N 3.24Å; L412-K415 PolarHBondContact O-N 3.45Å; L412-Y416 HydrophobicContact CB-CD2 4.42Å; L412-Y416 HydrophobicContact CB-CE2 4.39Å; L412-Y416 HydrophobicContact CD2-CE2 4.2Å; L412-Y416 WeakPolarHBondContact O-CD2 3.27Å; L412-Y416 PolarHBondContact O-N 3.4Å
413	E	53.1	Low	49.9	Very low	115 Å²	115	87.9 Å²	87.9	54%	0.537	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-39.4	179.7	-75	-178.9	-172.7	0	0	113.1	R409 K415 Y416 G417	R409-E413 WeakPolarHBondContact CD-OE1 3.46Å; R409-E413 HydrophobicContact CG-CG 4.28Å; R409-E413 WeakPolarHBondContact CG-OE1 3.33Å; R409-E413 VanDerWaalsContact O-CB 3.32Å; R409-E413 WeakPolarHBondContact O-CB 3.34Å; R409-E413 WeakPolarHBondContact O-CG 3.39Å; R409-E413 PolarHBondContact O-N 3.27Å; E413-K415 VanDerWaalsContact C-N 3.3Å; E413-K415 PolarHBondContact O-N 2.89Å; E413-Y416 PolarHBondContact O-N 3.34Å; E413-G417 VanDerWaalsContact O-CA 3.25Å; E413-G417 WeakPolarHBondContact O-CA 3.47Å; E413-G417 PolarHBondContact O-N 3.47Å
414	D	50.9	Low	48.4	Very low	80 Å²	80	88 Å²	88	43%	0.428	40%	0.404	S	S	.	.	H	α-helix	trans	-73	-27.4	178.9	-156.3	24.8	0	0	0	110.8	N410 L412 R418	N410-D414 WeakPolarHBondContact O-CA 3.44Å; N410-D414 WeakPolarHBondContact O-CB 3.34Å; N410-D414 PolarHBondContact O-N 3.07Å; L412-D414 PolarHBondContact O-N 3.24Å; D414-R418 WeakPolarHBondContact O-CB 3.42Å; D414-R418 VanDerWaalsContact O-CG 3.31Å; D414-R418 WeakPolarHBondContact O-CG 3.42Å; D414-R418 PolarHBondContact O-N 3.2Å; D414-R418 VanDerWaalsContact O-N 3.14Å; D414-R418 IonicContact OD1-CZ 2.69Å; D414-R418 IonicContact OD1-NE 3.25Å; D414-R418 PolarHBondContact OD1-NE 2.95Å; D414-R418 VanDerWaalsContact OD1-NE 3.15Å; D414-R418 IonicContact OD1-NH2 3.45Å; D414-R418 IonicContact OD2-CZ 2.68Å; D414-R418 IonicContact OD2-NE 2.9Å; D414-R418 PolarHBondContact OD2-NE 3.12Å; D414-R418 IonicContact OD2-NH2 3.63Å; D414-R418 PolarHBondContact OD2-NH2 3.43Å
415	K	46.1	Very low	47.6	Very low	66 Å²	66	90.4 Å²	90.4	29%	0.287	42%	0.418	S	S	.	.	H	α-helix	trans	-73.7	-42.5	170.5	-80.6	176.2	179	167.3	0	112.7	I411 L412 E413	I411-K415 HydrophobicContact CG2-CD 4.32Å; I411-K415 VanDerWaalsContact O-CB 3.32Å; I411-K415 WeakPolarHBondContact O-CB 3.48Å; I411-K415 VanDerWaalsContact O-CG 3.28Å; I411-K415 WeakPolarHBondContact O-CG 3.33Å; I411-K415 PolarHBondContact O-N 3.46Å; L412-K415 PolarHBondContact O-N 3.45Å; E413-K415 VanDerWaalsContact C-N 3.3Å; E413-K415 PolarHBondContact O-N 2.89Å
416	Y	42	Very low	46.8	Very low	120 Å²	120	91.3 Å²	91.3	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-81.7	-29.3	179.2	-66.6	-64.6	0	0	0	113.4	Q71 L412 E413	Q71-Y416 PolarHBondContact NE2-OH 3.39Å; L412-Y416 HydrophobicContact CB-CD2 4.42Å; L412-Y416 HydrophobicContact CB-CE2 4.39Å; L412-Y416 HydrophobicContact CD2-CE2 4.2Å; L412-Y416 WeakPolarHBondContact O-CD2 3.27Å; L412-Y416 PolarHBondContact O-N 3.4Å; E413-Y416 PolarHBondContact O-N 3.34Å
417	G	37	Very low	45.5	Very low	32 Å²	32	92 Å²	92	33%	0.33	43%	0.425	S	S	.	.	H	α-helix	trans	-83.8	-32.8	-178.9	0	0	0	0	0	113.8	E413 H419 Q420 K421	E413-G417 VanDerWaalsContact O-CA 3.25Å; E413-G417 WeakPolarHBondContact O-CA 3.47Å; E413-G417 PolarHBondContact O-N 3.47Å; G417-H419 VanDerWaalsContact C-N 3.3Å; G417-Q420 PolarHBondContact O-N 3.36Å; G417-K421 PolarHBondContact O-N 3.15Å
418	R	39.7	Very low	44.4	Very low	136 Å²	136	94.3 Å²	94.3	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-33.6	167.7	-80.6	-176.7	-156.1	-173.8	5.4	112.1	D414 Q420 K421 S422	D414-R418 WeakPolarHBondContact O-CB 3.42Å; D414-R418 VanDerWaalsContact O-CG 3.31Å; D414-R418 WeakPolarHBondContact O-CG 3.42Å; D414-R418 PolarHBondContact O-N 3.2Å; D414-R418 VanDerWaalsContact O-N 3.14Å; D414-R418 IonicContact OD1-CZ 2.69Å; D414-R418 IonicContact OD1-NE 3.25Å; D414-R418 PolarHBondContact OD1-NE 2.95Å; D414-R418 VanDerWaalsContact OD1-NE 3.15Å; D414-R418 IonicContact OD1-NH2 3.45Å; D414-R418 IonicContact OD2-CZ 2.68Å; D414-R418 IonicContact OD2-NE 2.9Å; D414-R418 PolarHBondContact OD2-NE 3.12Å; D414-R418 IonicContact OD2-NH2 3.63Å; D414-R418 PolarHBondContact OD2-NH2 3.43Å; R418-Q420 PolarHBondContact O-N 3.26Å; R418-K421 PolarHBondContact O-N 3.02Å; R418-S422 WeakPolarHBondContact O-CB 3.34Å; R418-S422 PolarHBondContact O-N 3.26Å; R418-S422 PolarHBondContact O-OG 3.2Å
419	H	41.7	Very low	43.6	Very low	67 Å²	67	96 Å²	96	31%	0.31	45%	0.448	S	S	.	.	H	α-helix	trans	-61.7	-29.5	176.5	-84.6	4.5	0	0	0	113	Y279 G417 R423	Y279-H419 AromaticContact CD1-CE1 3.6Å; Y279-H419 AromaticContact CE1-CE1 3.95Å; G417-H419 VanDerWaalsContact C-N 3.3Å; H419-R423 WeakPolarHBondContact O-CB 3.32Å; H419-R423 WeakPolarHBondContact O-CD 3.43Å; H419-R423 WeakPolarHBondContact O-CG 3.49Å
420	Q	33.6	Very low	42.8	Very low	146 Å²	146	96 Å²	96	68%	0.682	46%	0.456	S	S	*	.	H	α-helix	trans	-77.2	-43.5	172.1	-91.7	-178	-23.8	0	0	113	G417 R418	G417-Q420 PolarHBondContact O-N 3.36Å; R418-Q420 PolarHBondContact O-N 3.26Å
421	K	36.3	Very low	41.8	Very low	160 Å²	160	97.4 Å²	97.4	70%	0.696	46%	0.462	S	S	*	.	H	α-helix	trans	-76.7	-29.3	-175.7	-71.8	-179.4	179	174.5	0	113.6	G417 R418	G417-K421 PolarHBondContact O-N 3.15Å; R418-K421 PolarHBondContact O-N 3.02Å
422	S	36.9	Very low	40.9	Very low	36 Å²	36	100.1 Å²	100.1	25%	0.252	48%	0.477	S	S	.	.	H	α-helix	trans	-75.4	-34.7	173.5	68.7	0	0	0	0	112.1	R418 Q424 K425 I426	R418-S422 WeakPolarHBondContact O-CB 3.34Å; R418-S422 PolarHBondContact O-N 3.26Å; R418-S422 PolarHBondContact O-OG 3.2Å; S422-Q424 VanDerWaalsContact C-N 3.26Å; S422-Q424 PolarHBondContact O-N 3.22Å; S422-K425 PolarHBondContact O-N 2.95Å; S422-I426 WeakPolarHBondContact O-CG1 3.47Å; S422-I426 PolarHBondContact O-N 3.2Å
423	R	34.8	Very low	40.4	Very low	101 Å²	101	105.3 Å²	105.3	38%	0.381	50%	0.501	S	S	.	.	H	α-helix	trans	-56.8	-37.5	175.6	-83.3	172.7	97.5	-166.2	7.2	112.8	H419 F427	H419-R423 WeakPolarHBondContact O-CB 3.32Å; H419-R423 WeakPolarHBondContact O-CD 3.43Å; H419-R423 WeakPolarHBondContact O-CG 3.49Å; R423-F427 WeakPolarHBondContact O-CD2 3.37Å
424	Q	33.6	Very low	39.8	Very low	152 Å²	152	110.7 Å²	110.7	71%	0.71	52%	0.516	S	S	*	.	H	α-helix	trans	-77.1	-31.6	179	-73.8	180	-16.4	0	0	113.6	S422	S422-Q424 VanDerWaalsContact C-N 3.26Å; S422-Q424 PolarHBondContact O-N 3.22Å
425	K	41.7	Very low	39.3	Very low	170 Å²	170	110 Å²	110	74%	0.739	52%	0.518	S	S	*	.	H	α-helix	trans	-84.5	-33.6	-176.6	-73.8	-173.8	177.7	-176.6	0	113.9	S422 S429	S422-K425 PolarHBondContact O-N 2.95Å; K425-S429 PolarHBondContact O-OG 3.44Å
426	I	42.4	Very low	39.1	Very low	62 Å²	62	110.5 Å²	110.5	32%	0.318	53%	0.529	S	S	.	.	H	α-helix	trans	-79.4	-35.9	-177.9	-60	169	0	0	0	111	S422 H428	S422-I426 WeakPolarHBondContact O-CG1 3.47Å; S422-I426 PolarHBondContact O-N 3.2Å; I426-H428 PolarHBondContact O-N 3.42Å
427	F	35.7	Very low	39.2	Very low	108 Å²	108	112.7 Å²	112.7	47%	0.474	54%	0.544	S	S	.	.	H	α-helix	trans	-72.4	-24.2	178.3	-91.2	-90.4	0	0	0	114.3	R423 I431	R423-F427 WeakPolarHBondContact O-CD2 3.37Å; F427-I431 HydrophobicContact CD1-CD1 3.84Å; F427-I431 HydrophobicContact CE1-CD1 4.38Å
428	H	38.7	Very low	39.4	Very low	162 Å²	162	115.1 Å²	115.1	75%	0.75	56%	0.561	S	S	*	*	H	α-helix	trans	-88.6	-19.4	-178.7	-106.2	49.9	0	0	0	114.5	I426	I426-H428 PolarHBondContact O-N 3.42Å
429	S	41.8	Very low	39.5	Very low	52 Å²	52	116.8 Å²	116.8	36%	0.364	57%	0.574	S	S	.	*	H	α-helix	trans	-94.8	-27	-179.3	62.2	0	0	0	0	114.4	K425	K425-S429 PolarHBondContact O-OG 3.44Å
430	D	42.5	Very low	39.4	Very low	100 Å²	100	122.2 Å²	122.2	54%	0.535	60%	0.602	S	S	.	*	H	α-helix	trans	-108.8	-14	-162.7	-63.1	-8.3	0	0	0	114.3
431	I	42.4	Very low	39.5	Very low	109 Å²	109	119.1 Å²	119.1	56%	0.559	61%	0.609	S	S	*	*	H	α-helix	trans	-78.3	-24.3	173.1	-68.2	174.7	0	0	0	112	F427 S435	F427-I431 HydrophobicContact CD1-CD1 3.84Å; F427-I431 HydrophobicContact CE1-CD1 4.38Å; I431-S435 PolarHBondContact O-OG 3.4Å
432	N	38.5	Very low	39.6	Very low	104 Å²	104	116.8 Å²	116.8	56%	0.556	61%	0.613	S	S	*	*	H	α-helix	trans	-88.6	-10	-179.1	-72.1	-24.2	0	0	0	114.5	S435 S436	N432-S435 PolarHBondContact O-OG 3.37Å; N432-S436 WeakPolarHBondContact O-CB 3.35Å; N432-S436 PolarHBondContact O-OG 3.46Å
433	H	40	Very low	39.7	Very low	134 Å²	134	124 Å²	124	62%	0.62	65%	0.645	S	S	*	*	H	α-helix	trans	-90.6	-23.2	179.4	-105	-50.4	0	0	0	114.4
434	R	39.2	Very low	39.8	Very low	227 Å²	227	124.6 Å²	124.6	86%	0.857	66%	0.664	S	S	*	*	H	α-helix	trans	-81.6	-25.8	172.4	-97.5	-175.1	173.1	-160.5	-0.1	113.7
435	S	41.3	Very low	40.1	Very low	67 Å²	67	129.4 Å²	129.4	47%	0.469	68%	0.676	S	S	.	*	H	α-helix	trans	-82.2	-27	174.9	51.2	0	0	0	0	113.3	I431 N432	I431-S435 PolarHBondContact O-OG 3.4Å; N432-S435 PolarHBondContact O-OG 3.37Å
436	S	42.2	Very low	40	Very low	76 Å²	76	127.2 Å²	127.2	53%	0.531	68%	0.682	S	S	.	*	H	α-helix	trans	-85.9	-15.3	-177	-55.7	0	0	0	0	114.6	N432	N432-S436 WeakPolarHBondContact O-CB 3.35Å; N432-S436 PolarHBondContact O-OG 3.46Å
437	Q	43.1	Very low	40	Very low	166 Å²	166	128.8 Å²	128.8	78%	0.776	70%	0.699	S	S	*	*	S	Bend	trans	-96.1	-13.7	173.9	-91.8	-179.7	-6.8	0	0	114
438	A	42.6	Very low	40.4	Very low	83 Å²	83	131 Å²	131	69%	0.686	72%	0.716	S	S	*	*	S	Bend	trans	-87.7	-3.6	-180	0	0	0	0	0	114.3
439	H	40.4	Very low	40.6	Very low	171 Å²	171	127.3 Å²	127.3	79%	0.792	71%	0.713	S	S	*	*	S	Bend	trans	-120.1	11.3	-175	-114.9	-53.9	0	0	0	115.7
440	M	40.2	Very low	40.8	Very low	180 Å²	180	133.8 Å²	133.8	89%	0.887	74%	0.737	S	S	*	*	S	Bend	trans	-124.7	67.6	179	-70.1	-88	170.7	0	0	109.5
441	G	35.9	Very low	41.1	Very low	81 Å²	81	144 Å²	144	84%	0.835	77%	0.768	S	S	*	*			trans	-150.7	7.2	-175.5	0	0	0	0	0	116.5
442	S	37.8	Very low	41	Very low	112 Å²	112	145.8 Å²	145.8	78%	0.783	78%	0.779	S	S	*	*			trans	-134	48.9	-174.3	76.6	0	0	0	0	114.3
443	M	38.4	Very low	41.2	Very low	186 Å²	186	148 Å²	148	92%	0.916	79%	0.79	S	S	*	*			trans	-149.5	98.8	164.7	-67.8	-167.4	97.2	0	0	110.4
444	S	38.3	Very low	41.2	Very low	114 Å²	114	148.8 Å²	148.8	80%	0.797	80%	0.8	S	S	*	*			trans	154.4	104.8	143.9	51.3	0	0	0	0	110.6
445	R	39.2	Very low	41.4	Very low	254 Å²	254	144.2 Å²	144.2	96%	0.958	80%	0.796	S	S	*	*			trans	175.8	92.6	145.4	-98.8	168.7	-177	-152.3	0	108.6
446	S	39.8	Very low	41.4	Very low	124 Å²	124	149 Å²	149	87%	0.867	82%	0.817	S	S	*	*			trans	-154.2	93.9	142.4	-153.9	0	0	0	0	106.9
447	S	42.8	Very low	41.3	Very low	95 Å²	95	153.9 Å²	153.9	66%	0.664	84%	0.836	S	S	*	*			trans	-66.4	132.1	151.7	45.8	0	0	0	0	107.6
448	D	42.5	Very low	41.2	Very low	155 Å²	155	153 Å²	153	83%	0.829	84%	0.84	S	S	*	*			trans	157.2	148.6	134.6	-77.8	-21.9	0	0	0	111
449	A	44.5	Very low	41.1	Very low	83 Å²	83	158.4 Å²	158.4	69%	0.686	85%	0.852	S	S	*	*			trans	94.8	98.8	168.5	0	0	0	0	0	118.2
450	H	45.8	Very low	41.1	Very low	189 Å²	189	157.3 Å²	157.3	88%	0.875	86%	0.857	S	S	*	*			trans	58.6	105.3	130	-61.3	-65.3	0	0	0	118.9
451	R	48.6	Very low	41.2	Very low	315 Å²	315	155.3 Å²	155.3	100%	1.189	86%	0.855	S	S	*	*				-178.9	0	88.6	-162.9	174.6	-170.7	-169.5	2.6	110.1

Retrieved 451 of 451 residues in 354.5 ms (Link to these results)

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