A0A077Z0J5_TRITR Loading...

26S proteasome regulatory complex ATPase RPT2

AlphaFold DB , UniProt , Accession A0A077Z0J5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 440 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	45.1	Very low	41.5	Very low	253 Å²	253	139.3 Å²	139.3	100%	1.246	81%	0.814	S	S	*	*				0	126.7	0	-77.7	-177.3	171.1	0	0	107.6
2	G	48.9	Very low	41.4	Very low	71 Å²	71	143 Å²	143	73%	0.732	82%	0.817	S	S	*	*			trans	89.5	86.3	179	0	0	0	0	0	114.5
3	Q	45	Very low	40.9	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	82%	0.817	S	S	*	*				55.4	135.3	78.8	-78.9	-177.6	2	0	0	113
4	H	44.7	Very low	40.4	Very low	136 Å²	136	133 Å²	133	63%	0.63	81%	0.808	S	S	*	*			cis	-158.3	133.6	7	-105.3	-76.8	0	0	0	104.6
5	Q	42.9	Very low	40.4	Very low	157 Å²	157	133.3 Å²	133.3	73%	0.734	80%	0.803	S	S	*	*				76.7	122.8	73.7	-135.5	179.8	34.1	0	0	115.5
6	S	42.8	Very low	40.6	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	81%	0.813	S	S	*	*			trans	68.1	140.5	148	30.3	0	0	0	0	117.9
7	T	40.3	Very low	40.7	Very low	140 Å²	140	140.9 Å²	140.9	86%	0.859	81%	0.81	S	S	*	*			cis	-175	132.5	21.1	12.6	0	0	0	0	104.5
8	G	37.8	Very low	40.7	Very low	84 Å²	84	138.8 Å²	138.8	87%	0.866	80%	0.795	S	S	*	*				116.7	132.7	85.1	0	0	0	0	0	110.2
9	G	36.8	Very low	40.9	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	80%	0.796	S	S	*	*			trans	146.4	79.2	165.3	0	0	0	0	0	118.7
10	R	37.3	Very low	40.9	Very low	247 Å²	247	141.9 Å²	141.9	93%	0.932	80%	0.797	S	S	*	*			trans	61.8	115.4	137.8	-69.2	-179.6	171	177.1	-2.7	122
11	S	35.3	Very low	40.8	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	79%	0.793	S	S	*	*				82.9	113.8	117.7	-174.9	0	0	0	0	121.2
12	H	40.3	Very low	40.4	Very low	184 Å²	184	139.1 Å²	139.1	85%	0.852	77%	0.772	S	S	*	*			trans	134.9	120	145	-88.8	17.5	0	0	0	107.9
13	G	35	Very low	39.9	Very low	79 Å²	79	145.2 Å²	145.2	81%	0.814	78%	0.778	S	S	*	*			cis	100.9	80.9	29.8	0	0	0	0	0	108.8
14	G	33.8	Very low	39.5	Very low	67 Å²	67	147.8 Å²	147.8	69%	0.691	78%	0.78	S	S	*	*			trans	118.3	108.9	169.9	0	0	0	0	0	114.2
15	D	40.5	Very low	38.9	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	79%	0.788	S	S	*	*				163.7	92	124.8	-84.1	-26.1	0	0	0	110.7
16	K	42.9	Very low	38.4	Very low	220 Å²	220	152.8 Å²	152.8	96%	0.957	80%	0.796	S	S	*	*			trans	-116	30.8	168.5	-98.5	-174	177	178.4	0	110.6
17	K	42.5	Very low	38.2	Very low	176 Å²	176	156.5 Å²	156.5	77%	0.765	80%	0.803	S	S	*	*			trans	-116.9	-0.9	-175.2	-100.6	-175.7	174.8	-178.6	0	116.2
18	D	41.5	Very low	38.5	Very low	102 Å²	102	153.8 Å²	153.8	55%	0.545	79%	0.794	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.7	-5.4	-171	-69.2	-8.6	0	0	0	116
19	D	44.2	Very low	38.9	Very low	152 Å²	152	155.6 Å²	155.6	81%	0.813	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-1.6	-179.5	-86.3	-29.5	0	0	0	114.8
20	K	41.3	Very low	39.5	Very low	188 Å²	188	157.9 Å²	157.9	82%	0.817	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-9.2	175.4	-96	-178.4	176.5	178	0	114.9
21	E	38.2	Very low	39.6	Very low	152 Å²	152	151.7 Å²	151.7	71%	0.71	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-21.5	177	-92.9	179.8	162.5	0	0	114	K23 R24	E21-K23 PolarHBondContact O-N 2.78Å; E21-R24 PolarHBondContact O-N 3.38Å
22	K	37.5	Very low	40	Very low	185 Å²	185	151.2 Å²	151.2	80%	0.804	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	5.2	177.5	-75.4	-179.5	177.4	173.3	0	115.7
23	K	37.3	Very low	40.1	Very low	199 Å²	199	153.3 Å²	153.3	87%	0.865	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	10.8	174	-91.2	-177.4	176.3	177.5	0	114.5	E21	E21-K23 PolarHBondContact O-N 2.78Å
24	R	35.7	Very low	40.1	Very low	229 Å²	229	154.5 Å²	154.5	86%	0.864	76%	0.758	S	S	*	*	S	Bend	trans	-117.4	4.5	178.3	-76.3	-175.2	168.1	-169.9	-4.2	115.7	E21	E21-R24 PolarHBondContact O-N 3.38Å
25	M	32.2	Very low	40.3	Very low	159 Å²	159	155 Å²	155	78%	0.783	76%	0.763	S	S	*	*			trans	-105.9	74.4	166.2	-79.9	176.4	76.3	0	0	110.1
26	R	33.3	Very low	40.2	Very low	239 Å²	239	157.3 Å²	157.3	90%	0.902	77%	0.766	S	S	*	*			trans	-108.2	95.2	146.9	-79.7	-176.9	174.9	-176.3	-3.8	103.9	A28	R26-A28 PolarHBondContact O-N 3.28Å; R26-A28 VanDerWaalsContact O-N 3.13Å
27	E	38.8	Very low	40	Very low	171 Å²	171	156 Å²	156	80%	0.799	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-54.2	118.5	170.8	-75.4	176.8	153.6	0	0	106.9
28	A	46.9	Very low	39.6	Very low	82 Å²	82	153.6 Å²	153.6	68%	0.678	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-56.9	136.2	168.7	0	0	0	0	0	107.1	R26 V30	R26-A28 PolarHBondContact O-N 3.28Å; R26-A28 VanDerWaalsContact O-N 3.13Å; A28-V30 PolarHBondContact O-N 3.43Å
29	P	45	Very low	39.2	Very low	123 Å²	123	159 Å²	159	80%	0.799	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-54	131.3	176.9	22.9	-31.2	0	0	0	108.3
30	V	49.1	Very low	38.8	Very low	124 Å²	124	161.3 Å²	161.3	75%	0.752	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-50.2	130.2	176.4	-178.2	0	0	0	0	107.1	A28 T32	A28-V30 PolarHBondContact O-N 3.43Å; V30-T32 PolarHBondContact O-N 3.26Å
31	P	40.7	Very low	38.4	Very low	116 Å²	116	155.2 Å²	155.2	75%	0.753	75%	0.751	S	S	*	*			trans	-60.2	111.4	-179.6	24.1	-31.6	0	0	0	108	R33	P31-R33 PolarHBondContact O-N 3.45Å
32	T	43.1	Very low	38	Very low	90 Å²	90	153.5 Å²	153.5	55%	0.552	74%	0.741	S	S	*	*			trans	-58.7	131.9	172.5	48.6	0	0	0	0	107	V30 F34	V30-T32 PolarHBondContact O-N 3.26Å; T32-F34 PolarHBondContact O-N 3.26Å
33	R	42.1	Very low	38.2	Very low	229 Å²	229	146.4 Å²	146.4	86%	0.864	72%	0.721	S	S	*	*			trans	-71	25.7	-176.9	-82.8	-175.2	172.6	-171.5	2.2	113.2	P31	P31-R33 PolarHBondContact O-N 3.45Å
34	F	35.2	Very low	38.3	Very low	104 Å²	104	142 Å²	142	46%	0.456	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	121.5	179.1	-85.4	-90.4	0	0	0	109.9	T32 L145	T32-F34 PolarHBondContact O-N 3.26Å; F34-L145 WeakPolarHBondContact CE1-O 3.2Å
35	G	39.4	Very low	38.6	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	125.8	-0.3	177.6	0	0	0	0	0	116.4	R37	G35-R37 PolarHBondContact O-N 3.3Å; G35-R37 VanDerWaalsContact O-N 3.08Å
36	K	38	Very low	39.3	Very low	186 Å²	186	131.4 Å²	131.4	81%	0.809	69%	0.689	S	S	*	*	S	Bend	trans	-81.8	87.2	170.1	-79.9	-171.1	178.5	179.8	0	111.1
37	R	37.3	Very low	40.2	Very low	193 Å²	193	124 Å²	124	73%	0.728	68%	0.68	S	S	*	*			trans	50.5	119.1	159.8	-78.3	179.7	149.1	175.5	-8.8	115.6	G35 R39 S321	G35-R37 PolarHBondContact O-N 3.3Å; G35-R37 VanDerWaalsContact O-N 3.08Å; R37-R39 PolarHBondContact O-N 3.24Å; R37-S321 PolarHBondContact NH2-OG 2.66Å
38	K	35.3	Very low	40.9	Very low	125 Å²	125	121.9 Å²	121.9	54%	0.543	67%	0.67	S	S	.	*			trans	-49.5	79.8	154	-76.5	-173.7	174.9	-177.9	0	110.8	E276	K38-E276 IonicContact NZ-OE1 2.76Å; K38-E276 PolarHBondContact NZ-OE1 3.36Å
39	R	33.4	Very low	41.2	Very low	216 Å²	216	123.9 Å²	123.9	82%	0.815	66%	0.663	S	S	*	*			trans	-90.9	123.5	141.5	-76.9	-176	162.5	179.5	-4.7	102.4	R37 G41	R37-R39 PolarHBondContact O-N 3.24Å; R39-G41 PolarHBondContact O-N 3.32Å
40	K	35.4	Very low	42	Very low	199 Å²	199	124 Å²	124	87%	0.865	66%	0.656	S	S	*	*			trans	-36	111.3	158.7	-82.4	-175.9	172.9	179.2	0	106.5	K42	K40-K42 PolarHBondContact O-N 3.21Å
41	G	32.1	Very low	42.8	Very low	61 Å²	61	121.9 Å²	121.9	63%	0.629	65%	0.645	S	S	*	*			trans	-51.9	112.2	-174	0	0	0	0	0	106.4	R39 G43	R39-G41 PolarHBondContact O-N 3.32Å; G41-G43 VanDerWaalsContact C-N 3.29Å; G41-G43 PolarHBondContact O-N 3.31Å
42	K	31.2	Very low	44.1	Very low	115 Å²	115	123.3 Å²	123.3	50%	0.5	64%	0.641	S	S	.	*			trans	-59.1	107.5	163.8	-79.3	177.2	148.1	-160.2	0	103.7	K40 D45	K40-K42 PolarHBondContact O-N 3.21Å; K42-D45 WeakPolarHBondContact CD-OD1 3.26Å; K42-D45 IonicContact NZ-OD1 3.05Å; K42-D45 PolarHBondContact NZ-OD1 3.02Å
43	G	40	Very low	45.1	Very low	37 Å²	37	120.2 Å²	120.2	38%	0.381	62%	0.622	S	S	.	*	S	Bend	trans	-42	150.5	159.7	0	0	0	0	0	108.4	G41 D45	G41-G43 VanDerWaalsContact C-N 3.29Å; G41-G43 PolarHBondContact O-N 3.31Å; G43-D45 PolarHBondContact O-N 3.23Å; G43-D45 VanDerWaalsContact O-N 3.09Å
44	P	40.9	Very low	46.4	Very low	107 Å²	107	112.4 Å²	112.4	70%	0.695	60%	0.6	S	S	*	*	S	Bend	trans	-36	120.4	-159.6	17.9	-32.7	0	0	0	109.5	A46 A47	P44-A46 CarbonylContact O-C 3.5Å; P44-A46 WeakPolarHBondContact O-CA 3.33Å; P44-A46 PolarHBondContact O-N 3.27Å; P44-A47 PolarHBondContact O-N 3.27Å
45	D	41.6	Very low	48.1	Very low	72 Å²	72	109.7 Å²	109.7	39%	0.385	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.3	-5.1	-164.8	-150.1	20	0	0	0	113.9	K42 G43 K49	K42-D45 WeakPolarHBondContact CD-OD1 3.26Å; K42-D45 IonicContact NZ-OD1 3.05Å; K42-D45 PolarHBondContact NZ-OD1 3.02Å; G43-D45 PolarHBondContact O-N 3.23Å; G43-D45 VanDerWaalsContact O-N 3.09Å; D45-K49 IonicContact OD1-NZ 3.58Å; D45-K49 IonicContact OD2-NZ 2.73Å; D45-K49 PolarHBondContact OD2-NZ 3.16Å
46	A	47.1	Very low	49.6	Very low	93 Å²	93	112.2 Å²	112.2	77%	0.769	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-34.2	163.8	0	0	0	0	0	115.4	P44	P44-A46 CarbonylContact O-C 3.5Å; P44-A46 WeakPolarHBondContact O-CA 3.33Å; P44-A46 PolarHBondContact O-N 3.27Å
47	A	51.8	Low	51.3	Low	84 Å²	84	106.8 Å²	106.8	69%	0.694	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-19.3	-174.4	0	0	0	0	0	114	P44	P44-A47 PolarHBondContact O-N 3.27Å
48	Q	53	Low	53.2	Low	126 Å²	126	109.8 Å²	109.8	59%	0.589	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-7.8	-175	-75.1	-173.2	-7.7	0	0	115	L50	Q48-L50 PolarHBondContact O-N 3.12Å
49	K	53.9	Low	55.3	Low	124 Å²	124	106.3 Å²	106.3	54%	0.539	57%	0.571	S	S	.	*			trans	-97.1	87.4	178.7	-82	174.9	177	164.4	0	110.4	D45	D45-K49 IonicContact OD1-NZ 3.58Å; D45-K49 IonicContact OD2-NZ 2.73Å; D45-K49 PolarHBondContact OD2-NZ 3.16Å
50	L	62.1	Low	57.9	Low	126 Å²	126	105.7 Å²	105.7	66%	0.66	57%	0.569	S	S	*	*			trans	-48.1	131.8	150.1	-76.8	165.4	0	0	0	107.8	Q48 H52 I69 L73	Q48-L50 PolarHBondContact O-N 3.12Å; L50-H52 PolarHBondContact O-N 3.22Å; L50-I69 HydrophobicContact CD2-CG2 3.8Å; L50-L73 HydrophobicContact CD2-CD1 4.17Å
51	P	65.9	Low	60.2	Low	79 Å²	79	101.5 Å²	101.5	51%	0.513	56%	0.555	S	S	.	*			trans	-51.7	136.6	177.6	-24.4	30.2	0	0	0	110.6	V53 I69	P51-V53 VanDerWaalsContact O-CG2 3.24Å; P51-V53 WeakPolarHBondContact O-CG2 3.43Å; P51-V53 PolarHBondContact O-N 3.3Å; P51-I69 HydrophobicContact CB-CD1 3.96Å; P51-I69 HydrophobicContact CB-CG1 4.47Å; P51-I69 HydrophobicContact CG-CD1 3.99Å; P51-I69 HydrophobicContact CG-CG1 4.08Å; P51-I69 HydrophobicContact CG-CG2 4.49Å
52	H	66.5	Low	62.7	Low	145 Å²	145	102.2 Å²	102.2	67%	0.671	54%	0.541	S	S	*	.			trans	-61.4	108.5	-174.8	-163.6	-79.2	0	0	0	111.2	L50 T54 H56	L50-H52 PolarHBondContact O-N 3.22Å; H52-T54 PolarHBondContact O-N 3.45Å; H52-H56 AromaticContact CE1-CE1 3.55Å; H52-H56 AromaticContact CE1-NE2 3.48Å; H52-H56 PolarHBondContact CE1-NE2 2.88Å; H52-H56 AromaticContact NE2-CE1 4Å
53	V	64.9	Low	65.3	Low	26 Å²	26	101.5 Å²	101.5	16%	0.158	54%	0.542	C	S	.	.			trans	-89.4	96.7	-176.3	-167.8	0	0	0	0	110.8	P51 K62 K65 I69	P51-V53 VanDerWaalsContact O-CG2 3.24Å; P51-V53 WeakPolarHBondContact O-CG2 3.43Å; P51-V53 PolarHBondContact O-N 3.3Å; V53-K62 HydrophobicContact CG1-CG 3.89Å; V53-K65 HydrophobicContact CG1-CB 3.61Å; V53-K65 HydrophobicContact CG1-CD 4.03Å; V53-K65 HydrophobicContact CG1-CG 4.47Å; V53-I69 HydrophobicContact CG2-CD1 3.58Å
54	T	69.3	Low	67.6	Low	65 Å²	65	103.5 Å²	103.5	40%	0.399	54%	0.544	S	S	.	.	S	Bend	trans	-94.9	138.7	166.5	49.6	0	0	0	0	110.7	H52 K65	H52-T54 PolarHBondContact O-N 3.45Å; T54-K65 WeakPolarHBondContact O-CD 3.45Å; T54-K65 PolarHBondContact O-NZ 2.95Å
55	P	70.9	Confident	69.8	Low	47 Å²	47	102.8 Å²	102.8	31%	0.305	53%	0.53	S	S	.	.			cis	-87.4	154.1	8.7	32.9	-32.7	0	0	0	114.6	S57 C59 L61	P55-S57 VanDerWaalsContact C-N 3.33Å; P55-C59 HydrophobicContact CG-CB 4.26Å; P55-L61 HydrophobicContact CG-CB 4.45Å
56	H	70.4	Confident	71.9	Confident	131 Å²	131	102 Å²	102	61%	0.606	53%	0.529	S	S	*	.			trans	-72.7	-24.2	178.7	-65.1	-71.3	0	0	0	113.9	H52 K62	H52-H56 AromaticContact CE1-CE1 3.55Å; H52-H56 AromaticContact CE1-NE2 3.48Å; H52-H56 PolarHBondContact CE1-NE2 2.88Å; H52-H56 AromaticContact NE2-CE1 4Å; H56-K62 PolarHBondContact O-NZ 3.47Å
57	S	74.6	Confident	73.9	Confident	72 Å²	72	101.7 Å²	101.7	50%	0.503	51%	0.512	S	S	.	.	S	Bend	trans	-56.5	152.1	174.7	172.2	0	0	0	0	112.6	P55 C59	P55-S57 VanDerWaalsContact C-N 3.33Å; S57-C59 PolarHBondContact O-N 3.37Å; S57-C59 PolarHBondContact OG-SG 2.78Å
58	R	77.5	Confident	75.7	Confident	256 Å²	256	104.9 Å²	104.9	97%	0.966	51%	0.506	S	S	*	.	S	Bend	trans	-69.4	75.5	171.9	-69.4	-177.5	102	175.7	6	109.9
59	C	79.5	Confident	77.4	Confident	52 Å²	52	100.2 Å²	100.2	35%	0.351	49%	0.485	S	S	.	.			trans	-116.8	150.3	177.8	-62.8	0	0	0	0	110.9	P55 S57 L61 K62 L63	P55-C59 HydrophobicContact CG-CB 4.26Å; S57-C59 PolarHBondContact O-N 3.37Å; S57-C59 PolarHBondContact OG-SG 2.78Å; C59-L61 PolarHBondContact O-N 3.45Å; C59-L61 VanDerWaalsContact O-N 3.13Å; C59-K62 WeakPolarHBondContact O-CB 3.24Å; C59-K62 PolarHBondContact O-N 3.11Å; C59-L63 PolarHBondContact O-N 2.98Å
60	R	86.7	Confident	79.2	Confident	203 Å²	203	100.6 Å²	100.6	77%	0.766	49%	0.487	S	S	*	.	H	α-helix	trans	-55.5	-29.9	173.7	-171.1	174	178.9	157.6	-0	113.1	K62 L63 L64	R60-K62 VanDerWaalsContact C-N 3.34Å; R60-K62 PolarHBondContact O-N 3.41Å; R60-L63 PolarHBondContact O-N 2.86Å; R60-L64 HydrophobicContact CG-CD1 4.14Å; R60-L64 HydrophobicContact CG-CG 4.37Å; R60-L64 WeakPolarHBondContact O-CG 3.32Å; R60-L64 PolarHBondContact O-N 3.05Å
61	L	84.4	Confident	80.7	Confident	110 Å²	110	99.2 Å²	99.2	58%	0.576	48%	0.48	S	S	*	.	H	α-helix	trans	-62.1	-36.8	175.4	-73.4	169.1	0	0	0	113.4	P55 C59 K65	P55-L61 HydrophobicContact CG-CB 4.45Å; C59-L61 PolarHBondContact O-N 3.45Å; C59-L61 VanDerWaalsContact O-N 3.13Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.35Å; L61-K65 VanDerWaalsContact O-N 3.13Å
62	K	84	Confident	81.9	Confident	76 Å²	76	102.3 Å²	102.3	33%	0.33	48%	0.483	S	S	.	.	H	α-helix	trans	-66.6	-46.2	176.4	-174	-176.6	-176.4	177.7	0	110.2	V53 H56 C59 R60 K65 S66	V53-K62 HydrophobicContact CG1-CG 3.89Å; H56-K62 PolarHBondContact O-NZ 3.47Å; C59-K62 WeakPolarHBondContact O-CB 3.24Å; C59-K62 PolarHBondContact O-N 3.11Å; R60-K62 VanDerWaalsContact C-N 3.34Å; R60-K62 PolarHBondContact O-N 3.41Å; K62-K65 PolarHBondContact O-N 3.13Å; K62-S66 PolarHBondContact O-N 3.38Å; K62-S66 PolarHBondContact O-OG 2.89Å
63	L	87	Confident	82.9	Confident	101 Å²	101	99.6 Å²	99.6	53%	0.529	47%	0.472	S	S	.	.	H	α-helix	trans	-57.8	-51.6	176.8	-178	67.3	0	0	0	111.3	C59 R60 K65 S66 E67	C59-L63 PolarHBondContact O-N 2.98Å; R60-L63 PolarHBondContact O-N 2.86Å; L63-K65 VanDerWaalsContact C-N 3.32Å; L63-K65 PolarHBondContact O-N 3.38Å; L63-S66 PolarHBondContact O-N 3.41Å; L63-S66 VanDerWaalsContact O-N 3.12Å; L63-E67 HydrophobicContact CD1-CG 4.49Å; L63-E67 HydrophobicContact CG-CG 4.48Å; L63-E67 WeakPolarHBondContact O-CG 3.22Å; L63-E67 PolarHBondContact O-N 2.9Å
64	L	88.4	Confident	84.2	Confident	79 Å²	79	102 Å²	102	41%	0.414	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-37.9	-179.6	-72.4	169.1	0	0	0	112.9	R60 R68	R60-L64 HydrophobicContact CG-CD1 4.14Å; R60-L64 HydrophobicContact CG-CG 4.37Å; R60-L64 WeakPolarHBondContact O-CG 3.32Å; R60-L64 PolarHBondContact O-N 3.05Å; L64-R68 WeakPolarHBondContact O-CG 3.32Å; L64-R68 PolarHBondContact O-N 3.49Å; L64-R68 VanDerWaalsContact O-N 3.09Å
65	K	86.9	Confident	85.3	Confident	92 Å²	92	104.6 Å²	104.6	40%	0.4	50%	0.495	S	S	.	.	H	α-helix	trans	-68.1	-41.7	174.9	-78.5	-175.2	177.5	-177.9	0	111.8	V53 T54 L61 K62 L63 R68 I69	V53-K65 HydrophobicContact CG1-CB 3.61Å; V53-K65 HydrophobicContact CG1-CD 4.03Å; V53-K65 HydrophobicContact CG1-CG 4.47Å; T54-K65 WeakPolarHBondContact O-CD 3.45Å; T54-K65 PolarHBondContact O-NZ 2.95Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.35Å; L61-K65 VanDerWaalsContact O-N 3.13Å; K62-K65 PolarHBondContact O-N 3.13Å; L63-K65 VanDerWaalsContact C-N 3.32Å; L63-K65 PolarHBondContact O-N 3.38Å; K65-R68 PolarHBondContact O-N 3.04Å; K65-I69 VanDerWaalsContact O-CG1 3.32Å; K65-I69 WeakPolarHBondContact O-CG1 3.21Å; K65-I69 PolarHBondContact O-N 3.32Å
66	S	84.7	Confident	86.2	Confident	54 Å²	54	107.8 Å²	107.8	38%	0.378	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-38.1	176	-72.7	0	0	0	0	112.5	K62 L63 I69 K70	K62-S66 PolarHBondContact O-N 3.38Å; K62-S66 PolarHBondContact O-OG 2.89Å; L63-S66 PolarHBondContact O-N 3.41Å; L63-S66 VanDerWaalsContact O-N 3.12Å; S66-I69 PolarHBondContact O-N 3.25Å; S66-K70 WeakPolarHBondContact O-CB 3.31Å; S66-K70 PolarHBondContact O-N 3.21Å
67	E	90.2	Very high	87	Confident	87 Å²	87	107.1 Å²	107.1	41%	0.407	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-47.2	172.7	-75.2	172.5	169.3	0	0	110.9	L63 I69 K70 D71	L63-E67 HydrophobicContact CD1-CG 4.49Å; L63-E67 HydrophobicContact CG-CG 4.48Å; L63-E67 WeakPolarHBondContact O-CG 3.22Å; L63-E67 PolarHBondContact O-N 2.9Å; E67-I69 VanDerWaalsContact C-N 3.33Å; E67-I69 PolarHBondContact O-N 3.09Å; E67-K70 WeakPolarHBondContact O-CB 3.44Å; E67-K70 PolarHBondContact O-N 3.26Å; E67-K70 VanDerWaalsContact O-N 3.13Å; E67-D71 PolarHBondContact O-N 3.21Å
68	R	89.5	Confident	87.7	Confident	151 Å²	151	109.8 Å²	109.8	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-59	-42.5	175.2	-72.2	-174.9	70.5	148.1	4	113	L64 K65 K70 D71 Y72	L64-R68 WeakPolarHBondContact O-CG 3.32Å; L64-R68 PolarHBondContact O-N 3.49Å; L64-R68 VanDerWaalsContact O-N 3.09Å; K65-R68 PolarHBondContact O-N 3.04Å; R68-K70 VanDerWaalsContact C-N 3.34Å; R68-D71 PolarHBondContact O-N 3.41Å; R68-Y72 HydrophobicContact CB-CE2 4.42Å; R68-Y72 PolarHBondContact NH2-OH 3.45Å; R68-Y72 WeakPolarHBondContact O-CD2 3.42Å; R68-Y72 PolarHBondContact O-N 2.89Å
69	I	88.7	Confident	88.3	Confident	28 Å²	28	104.9 Å²	104.9	14%	0.144	49%	0.49	C	S	.	.	H	α-helix	trans	-63.1	-43.5	177.2	-67	163.4	0	0	0	110.3	L50 P51 V53 K65 S66 E67 D71 Y72 L73	L50-I69 HydrophobicContact CD2-CG2 3.8Å; P51-I69 HydrophobicContact CB-CD1 3.96Å; P51-I69 HydrophobicContact CB-CG1 4.47Å; P51-I69 HydrophobicContact CG-CD1 3.99Å; P51-I69 HydrophobicContact CG-CG1 4.08Å; P51-I69 HydrophobicContact CG-CG2 4.49Å; V53-I69 HydrophobicContact CG2-CD1 3.58Å; K65-I69 VanDerWaalsContact O-CG1 3.32Å; K65-I69 WeakPolarHBondContact O-CG1 3.21Å; K65-I69 PolarHBondContact O-N 3.32Å; S66-I69 PolarHBondContact O-N 3.25Å; E67-I69 VanDerWaalsContact C-N 3.33Å; E67-I69 PolarHBondContact O-N 3.09Å; I69-D71 VanDerWaalsContact C-N 3.35Å; I69-D71 PolarHBondContact O-N 3.22Å; I69-Y72 PolarHBondContact O-N 3.41Å; I69-L73 HydrophobicContact CG2-CD1 3.83Å; I69-L73 WeakPolarHBondContact O-CG 3.3Å; I69-L73 PolarHBondContact O-N 3.33Å
70	K	90.7	Very high	88.5	Confident	132 Å²	132	106.3 Å²	106.3	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-59.9	-44.5	175.5	-178.2	-174.7	175.6	-174.8	0	111.5	S66 E67 R68 Y72 L73 L74	S66-K70 WeakPolarHBondContact O-CB 3.31Å; S66-K70 PolarHBondContact O-N 3.21Å; E67-K70 WeakPolarHBondContact O-CB 3.44Å; E67-K70 PolarHBondContact O-N 3.26Å; E67-K70 VanDerWaalsContact O-N 3.13Å; R68-K70 VanDerWaalsContact C-N 3.34Å; K70-Y72 PolarHBondContact O-N 2.93Å; K70-L73 PolarHBondContact O-N 3.23Å; K70-L74 HydrophobicContact CG-CD1 4Å; K70-L74 HydrophobicContact CG-CG 4.41Å; K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.45Å; K70-L74 PolarHBondContact O-N 3.05Å
71	D	93.9	Very high	88.4	Confident	98 Å²	98	101.5 Å²	101.5	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-41.2	179.9	-64.6	-21.8	0	0	0	111.6	E67 R68 I69 L75	E67-D71 PolarHBondContact O-N 3.21Å; R68-D71 PolarHBondContact O-N 3.41Å; I69-D71 VanDerWaalsContact C-N 3.35Å; I69-D71 PolarHBondContact O-N 3.22Å; D71-L75 VanDerWaalsContact O-CB 3.29Å; D71-L75 WeakPolarHBondContact O-CB 3.44Å; D71-L75 PolarHBondContact O-N 2.74Å
72	Y	90.7	Very high	88.5	Confident	144 Å²	144	100.4 Å²	100.4	57%	0.565	47%	0.473	S	S	*	.	H	α-helix	trans	-64.7	-42.7	174.9	-73	-60.2	0	0	0	112.5	R68 I69 K70 L75 E76	R68-Y72 HydrophobicContact CB-CE2 4.42Å; R68-Y72 PolarHBondContact NH2-OH 3.45Å; R68-Y72 WeakPolarHBondContact O-CD2 3.42Å; R68-Y72 PolarHBondContact O-N 2.89Å; I69-Y72 PolarHBondContact O-N 3.41Å; K70-Y72 PolarHBondContact O-N 2.93Å; Y72-L75 PolarHBondContact O-N 3.34Å; Y72-E76 WeakPolarHBondContact O-CB 3.34Å; Y72-E76 PolarHBondContact O-N 2.93Å
73	L	89.2	Confident	88.3	Confident	87 Å²	87	101 Å²	101	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-64.5	-43	177.6	-77	162.8	0	0	0	112	L50 I69 K70 L75 E76 E77	L50-L73 HydrophobicContact CD2-CD1 4.17Å; I69-L73 HydrophobicContact CG2-CD1 3.83Å; I69-L73 WeakPolarHBondContact O-CG 3.3Å; I69-L73 PolarHBondContact O-N 3.33Å; K70-L73 PolarHBondContact O-N 3.23Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 3.32Å; L73-E76 PolarHBondContact O-N 2.75Å; L73-E77 WeakPolarHBondContact O-CB 3.48Å; L73-E77 PolarHBondContact O-N 2.89Å
74	L	92.1	Very high	87.5	Confident	76 Å²	76	101.1 Å²	101.1	40%	0.398	48%	0.475	S	S	.	.	H	α-helix	trans	-63.9	-40.1	175.9	-75.5	172.9	0	0	0	111.5	K70 E76 E77 E78	K70-L74 HydrophobicContact CG-CD1 4Å; K70-L74 HydrophobicContact CG-CG 4.41Å; K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.45Å; K70-L74 PolarHBondContact O-N 3.05Å; L74-E76 VanDerWaalsContact C-N 3.34Å; L74-E77 PolarHBondContact O-N 2.77Å; L74-E78 WeakPolarHBondContact O-CB 3.4Å; L74-E78 WeakPolarHBondContact O-CG 3.35Å; L74-E78 PolarHBondContact O-N 3.48Å
75	L	91.8	Very high	86.8	Confident	120 Å²	120	106 Å²	106	63%	0.628	49%	0.488	S	S	*	.	H	α-helix	trans	-66.2	-37.9	177.1	-170.6	131	0	0	0	111.7	D71 Y72 L73 Y79	D71-L75 VanDerWaalsContact O-CB 3.29Å; D71-L75 WeakPolarHBondContact O-CB 3.44Å; D71-L75 PolarHBondContact O-N 2.74Å; Y72-L75 PolarHBondContact O-N 3.34Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 3.32Å; L75-Y79 WeakPolarHBondContact O-CB 3.49Å; L75-Y79 PolarHBondContact O-N 3.01Å
76	E	88.9	Confident	85.9	Confident	114 Å²	114	109.3 Å²	109.3	53%	0.533	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-43.1	173.4	-171.7	174	-162.7	0	0	111.9	Y72 L73 L74 Y79 L80	Y72-E76 WeakPolarHBondContact O-CB 3.34Å; Y72-E76 PolarHBondContact O-N 2.93Å; L73-E76 PolarHBondContact O-N 2.75Å; L74-E76 VanDerWaalsContact C-N 3.34Å; E76-Y79 WeakPolarHBondContact O-CB 3.35Å; E76-Y79 PolarHBondContact O-N 3.29Å; E76-L80 HydrophobicContact CG-CD1 4.31Å; E76-L80 WeakPolarHBondContact O-CB 3.37Å; E76-L80 WeakPolarHBondContact O-CG 3.49Å; E76-L80 PolarHBondContact O-N 3.29Å
77	E	88.2	Confident	85.1	Confident	117 Å²	117	111.2 Å²	111.2	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-47.2	175.5	-171.6	-172.5	164.3	0	0	111.5	L73 L74 Y79 L80 K81	L73-E77 WeakPolarHBondContact O-CB 3.48Å; L73-E77 PolarHBondContact O-N 2.89Å; L74-E77 PolarHBondContact O-N 2.77Å; E77-Y79 VanDerWaalsContact C-N 3.32Å; E77-Y79 PolarHBondContact O-N 2.92Å; E77-L80 PolarHBondContact O-N 2.81Å; E77-K81 WeakPolarHBondContact O-CB 3.43Å; E77-K81 PolarHBondContact O-N 3.32Å
78	E	89.5	Confident	83.9	Confident	128 Å²	128	111.7 Å²	111.7	60%	0.598	52%	0.519	S	S	*	.	H	α-helix	trans	-63	-39.4	175.1	-77.5	-167.1	165.1	0	0	111.7	L74 K81 N82	L74-E78 WeakPolarHBondContact O-CB 3.4Å; L74-E78 WeakPolarHBondContact O-CG 3.35Å; L74-E78 PolarHBondContact O-N 3.48Å; E78-K81 PolarHBondContact O-N 3.05Å; E78-N82 VanDerWaalsContact O-CB 3.24Å; E78-N82 WeakPolarHBondContact O-CB 3.39Å; E78-N82 PolarHBondContact O-N 3.13Å; E78-N82 PolarHBondContact O-ND2 3.28Å
79	Y	89.2	Confident	82.4	Confident	153 Å²	153	113.9 Å²	113.9	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-62	-48.8	176.3	-177.8	-94.6	0	0	0	111.4	L75 E76 E77 N82 Q83	L75-Y79 WeakPolarHBondContact O-CB 3.49Å; L75-Y79 PolarHBondContact O-N 3.01Å; E76-Y79 WeakPolarHBondContact O-CB 3.35Å; E76-Y79 PolarHBondContact O-N 3.29Å; E77-Y79 VanDerWaalsContact C-N 3.32Å; E77-Y79 PolarHBondContact O-N 2.92Å; Y79-N82 PolarHBondContact O-N 2.88Å; Y79-Q83 VanDerWaalsContact O-CB 3.31Å; Y79-Q83 WeakPolarHBondContact O-CB 3.44Å; Y79-Q83 PolarHBondContact O-N 2.89Å
80	L	84.7	Confident	80.8	Confident	83 Å²	83	119.4 Å²	119.4	44%	0.435	57%	0.565	S	S	.	*	H	α-helix	trans	-63	-44.9	177.4	-72.2	171.3	0	0	0	111.6	E76 E77 N82 Q83 E84	E76-L80 HydrophobicContact CG-CD1 4.31Å; E76-L80 WeakPolarHBondContact O-CB 3.37Å; E76-L80 WeakPolarHBondContact O-CG 3.49Å; E76-L80 PolarHBondContact O-N 3.29Å; E77-L80 PolarHBondContact O-N 2.81Å; L80-N82 VanDerWaalsContact C-N 3.34Å; L80-N82 PolarHBondContact O-N 3.05Å; L80-Q83 CarbonylContact O-C 3.54Å; L80-Q83 WeakPolarHBondContact O-CA 3.32Å; L80-Q83 WeakPolarHBondContact O-CB 3.39Å; L80-Q83 PolarHBondContact O-N 3.37Å; L80-Q83 VanDerWaalsContact O-N 3.14Å; L80-E84 WeakPolarHBondContact O-CB 3.19Å; L80-E84 WeakPolarHBondContact O-CG 3.33Å; L80-E84 PolarHBondContact O-N 3.16Å
81	K	84.7	Confident	79.1	Confident	102 Å²	102	116.8 Å²	116.8	44%	0.443	56%	0.558	S	S	.	*	H	α-helix	trans	-63.1	-39.5	177.8	-171.3	175.2	-171.5	168.4	0	112.4	E77 E78 E84 R85	E77-K81 WeakPolarHBondContact O-CB 3.43Å; E77-K81 PolarHBondContact O-N 3.32Å; E78-K81 PolarHBondContact O-N 3.05Å; K81-E84 PolarHBondContact O-N 3.28Å; K81-R85 WeakPolarHBondContact O-CB 2.95Å; K81-R85 VanDerWaalsContact O-CG 3.29Å; K81-R85 WeakPolarHBondContact O-CG 3.38Å; K81-R85 PolarHBondContact O-N 3.34Å
82	N	85.4	Confident	77.2	Confident	86 Å²	86	115.8 Å²	115.8	46%	0.46	55%	0.547	S	S	.	.	H	α-helix	trans	-68.7	-39.7	173.5	-74.9	-26.1	0	0	0	111.1	E78 Y79 L80 E84 R85 M86	E78-N82 VanDerWaalsContact O-CB 3.24Å; E78-N82 WeakPolarHBondContact O-CB 3.39Å; E78-N82 PolarHBondContact O-N 3.13Å; E78-N82 PolarHBondContact O-ND2 3.28Å; Y79-N82 PolarHBondContact O-N 2.88Å; L80-N82 VanDerWaalsContact C-N 3.34Å; L80-N82 PolarHBondContact O-N 3.05Å; N82-E84 VanDerWaalsContact C-N 3.3Å; N82-E84 PolarHBondContact O-N 3.27Å; N82-R85 PolarHBondContact O-N 3.29Å; N82-M86 WeakPolarHBondContact O-CB 3.13Å; N82-M86 VanDerWaalsContact O-CG 3.25Å; N82-M86 WeakPolarHBondContact O-CG 3.29Å; N82-M86 PolarHBondContact O-N 2.81Å
83	Q	79.7	Confident	75.4	Confident	90 Å²	90	114.7 Å²	114.7	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-62.4	-38.6	175	-166.4	178.7	19.1	0	0	111.3	Y79 L80 K87	Y79-Q83 VanDerWaalsContact O-CB 3.31Å; Y79-Q83 WeakPolarHBondContact O-CB 3.44Å; Y79-Q83 PolarHBondContact O-N 2.89Å; L80-Q83 CarbonylContact O-C 3.54Å; L80-Q83 WeakPolarHBondContact O-CA 3.32Å; L80-Q83 WeakPolarHBondContact O-CB 3.39Å; L80-Q83 PolarHBondContact O-N 3.37Å; L80-Q83 VanDerWaalsContact O-N 3.14Å; Q83-K87 WeakPolarHBondContact O-CB 3.43Å; Q83-K87 WeakPolarHBondContact O-CD 3.29Å; Q83-K87 VanDerWaalsContact O-CG 3.24Å; Q83-K87 WeakPolarHBondContact O-CG 3.47Å; Q83-K87 PolarHBondContact O-N 2.8Å
84	E	71	Confident	73.8	Confident	102 Å²	102	118.9 Å²	118.9	48%	0.477	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-38.3	173.9	-76.4	179.8	167.7	0	0	113.3	L80 K81 N82 K87	L80-E84 WeakPolarHBondContact O-CB 3.19Å; L80-E84 WeakPolarHBondContact O-CG 3.33Å; L80-E84 PolarHBondContact O-N 3.16Å; K81-E84 PolarHBondContact O-N 3.28Å; N82-E84 VanDerWaalsContact C-N 3.3Å; N82-E84 PolarHBondContact O-N 3.27Å; E84-K87 WeakPolarHBondContact O-CB 3.42Å
85	R	72.7	Confident	72.5	Confident	181 Å²	181	118.1 Å²	118.1	68%	0.683	56%	0.56	S	S	*	*	H	α-helix	trans	-70.3	-38.4	176.2	-79.4	176.2	171.7	-170	-3.9	113.9	K81 N82 K87	K81-R85 WeakPolarHBondContact O-CB 2.95Å; K81-R85 VanDerWaalsContact O-CG 3.29Å; K81-R85 WeakPolarHBondContact O-CG 3.38Å; K81-R85 PolarHBondContact O-N 3.34Å; N82-R85 PolarHBondContact O-N 3.29Å; R85-K87 PolarHBondContact O-N 2.92Å
86	M	69.2	Low	71.2	Confident	163 Å²	163	118.4 Å²	118.4	80%	0.803	56%	0.558	S	S	*	*	S	Bend	trans	-74.3	-16.5	179	-73.4	-63	-66.8	0	0	112.9	N82	N82-M86 WeakPolarHBondContact O-CB 3.13Å; N82-M86 VanDerWaalsContact O-CG 3.25Å; N82-M86 WeakPolarHBondContact O-CG 3.29Å; N82-M86 PolarHBondContact O-N 2.81Å
87	K	66.5	Low	70.3	Confident	93 Å²	93	119 Å²	119	40%	0.404	56%	0.561	S	S	.	*	S	Bend	trans	-71.1	123.4	176.4	-113.9	176.9	170	-170.8	0	104.5	Q83 E84 R85 Q89 R92	Q83-K87 WeakPolarHBondContact O-CB 3.43Å; Q83-K87 WeakPolarHBondContact O-CD 3.29Å; Q83-K87 VanDerWaalsContact O-CG 3.24Å; Q83-K87 WeakPolarHBondContact O-CG 3.47Å; Q83-K87 PolarHBondContact O-N 2.8Å; E84-K87 WeakPolarHBondContact O-CB 3.42Å; R85-K87 PolarHBondContact O-N 2.92Å; K87-Q89 PolarHBondContact O-N 3.48Å; K87-R92 VanDerWaalsContact C-NH2 3.28Å; K87-R92 VanDerWaalsContact CB-NE 3.27Å; K87-R92 VanDerWaalsContact CD-NE 3.25Å; K87-R92 PolarHBondContact O-NH1 3.4Å
88	P	66.5	Low	69.6	Low	98 Å²	98	114.8 Å²	114.8	64%	0.636	55%	0.549	S	S	*	.			trans	-53.9	133.9	-176.9	11.1	-26.9	0	0	0	115	D90 R92	P88-D90 VanDerWaalsContact C-N 3.27Å; P88-D90 PolarHBondContact O-N 3.4Å; P88-R92 PolarHBondContact O-NH1 3.29Å; P88-R92 PolarHBondContact O-NH2 2.96Å
89	Q	56.7	Low	69	Low	196 Å²	196	115 Å²	115	92%	0.916	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-6.1	-156.4	-159.5	170.8	-6.3	0	0	117.6	K87	K87-Q89 PolarHBondContact O-N 3.48Å
90	D	54.4	Low	68.4	Low	145 Å²	145	109.3 Å²	109.3	78%	0.775	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	1.9	-166.7	-83.7	-20.1	0	0	0	117	P88	P88-D90 VanDerWaalsContact C-N 3.27Å; P88-D90 PolarHBondContact O-N 3.4Å
91	D	55	Low	68.2	Low	77 Å²	77	109.5 Å²	109.5	41%	0.412	53%	0.526	S	S	.	.	S	Bend	trans	-144.3	2.6	-156.2	-106.1	-52.8	0	0	0	119.4	D95 R99	D91-D95 VanDerWaalsContact O-CB 3.28Å; D91-D95 WeakPolarHBondContact O-CB 2.99Å; D91-D95 VanDerWaalsContact OD1-OD2 3.12Å; D91-R99 IonicContact OD1-CZ 2.82Å; D91-R99 IonicContact OD1-NH2 3.96Å; D91-R99 PolarHBondContact OD1-NH2 2.72Å
92	R	54.5	Low	68	Low	77 Å²	77	111 Å²	111	29%	0.291	54%	0.539	S	S	.	.	S	Bend	trans	-111.5	-16.9	-149.5	-71.6	-150.7	-168.7	70.8	10.1	123	K87 P88	K87-R92 VanDerWaalsContact C-NH2 3.28Å; K87-R92 VanDerWaalsContact CB-NE 3.27Å; K87-R92 VanDerWaalsContact CD-NE 3.25Å; K87-R92 PolarHBondContact O-NH1 3.4Å; P88-R92 PolarHBondContact O-NH1 3.29Å; P88-R92 PolarHBondContact O-NH2 2.96Å
93	Q	54.1	Low	67.7	Low	121 Å²	121	111.8 Å²	111.8	57%	0.565	54%	0.543	S	S	*	.	S	Bend	trans	-142.2	-42.4	173	-72.4	-176.4	-8.4	0	0	110.7	D95 E96 H97	Q93-D95 VanDerWaalsContact C-N 3.29Å; Q93-D95 PolarHBondContact O-N 3.43Å; Q93-E96 PolarHBondContact O-N 3.06Å; Q93-H97 WeakPolarHBondContact O-CB 3.19Å; Q93-H97 PolarHBondContact O-CD2 2.94Å; Q93-H97 PolarHBondContact O-N 3.03Å
94	E	55.6	Low	67.7	Low	175 Å²	175	111.6 Å²	111.6	82%	0.818	54%	0.539	S	S	*	.	H	α-helix	trans	-63.5	-37.8	170.6	-70.2	-175.1	168.8	0	0	111.6	G98	E94-G98 WeakPolarHBondContact O-CA 3.33Å; E94-G98 PolarHBondContact O-N 3.14Å
95	D	63.2	Low	68	Low	59 Å²	59	107.5 Å²	107.5	32%	0.316	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-39	177.3	-99.8	46.9	0	0	0	113.2	D91 Q93 R99	D91-D95 VanDerWaalsContact O-CB 3.28Å; D91-D95 WeakPolarHBondContact O-CB 2.99Å; D91-D95 VanDerWaalsContact OD1-OD2 3.12Å; Q93-D95 VanDerWaalsContact C-N 3.29Å; Q93-D95 PolarHBondContact O-N 3.43Å; D95-R99 WeakPolarHBondContact O-CB 3.5Å; D95-R99 VanDerWaalsContact O-CD 3.3Å; D95-R99 WeakPolarHBondContact O-CD 3.49Å; D95-R99 WeakPolarHBondContact O-CG 3.3Å; D95-R99 PolarHBondContact O-N 2.62Å; D95-R99 IonicContact OD2-CZ 3.92Å; D95-R99 IonicContact OD2-NE 2.7Å; D95-R99 IonicContact OD2-NH2 2.81Å; D95-R99 PolarHBondContact OD2-NH2 3.47Å
96	E	66.1	Low	68.5	Low	127 Å²	127	104.2 Å²	104.2	59%	0.593	53%	0.528	S	S	*	.	H	α-helix	trans	-72	-44.8	176.8	-68.8	-169.8	168.9	0	0	111.3	Q93 R99 V100	Q93-E96 PolarHBondContact O-N 3.06Å; E96-R99 PolarHBondContact O-N 2.79Å; E96-V100 WeakPolarHBondContact O-CB 3.37Å; E96-V100 VanDerWaalsContact O-CG2 3.23Å; E96-V100 WeakPolarHBondContact O-CG2 3.45Å; E96-V100 PolarHBondContact O-N 2.77Å
97	H	68.6	Low	69.4	Low	127 Å²	127	100.6 Å²	100.6	59%	0.588	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-42.8	175.2	-77.9	-62.8	0	0	0	111.9	Q93 V100 D101	Q93-H97 WeakPolarHBondContact O-CB 3.19Å; Q93-H97 PolarHBondContact O-CD2 2.94Å; Q93-H97 PolarHBondContact O-N 3.03Å; H97-V100 PolarHBondContact O-N 3.05Å; H97-D101 WeakPolarHBondContact O-CB 3.39Å; H97-D101 PolarHBondContact O-N 3.17Å
98	G	74.9	Confident	70.3	Confident	28 Å²	28	100 Å²	100	29%	0.289	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-46.5	175.3	0	0	0	0	0	112.1	E94 V100 D101 D102	E94-G98 WeakPolarHBondContact O-CA 3.33Å; E94-G98 PolarHBondContact O-N 3.14Å; G98-V100 VanDerWaalsContact C-N 3.3Å; G98-V100 PolarHBondContact O-N 2.57Å; G98-D101 PolarHBondContact O-N 3.23Å; G98-D102 WeakPolarHBondContact O-CB 3.41Å; G98-D102 VanDerWaalsContact O-CG 3.28Å; G98-D102 PolarHBondContact O-N 3.07Å
99	R	75.3	Confident	71.4	Confident	131 Å²	131	97.1 Å²	97.1	49%	0.494	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-38.7	174.3	-74	168.1	-161.9	171.7	11	111.8	D91 D95 E96 L103	D91-R99 IonicContact OD1-CZ 2.82Å; D91-R99 IonicContact OD1-NH2 3.96Å; D91-R99 PolarHBondContact OD1-NH2 2.72Å; D95-R99 WeakPolarHBondContact O-CB 3.5Å; D95-R99 VanDerWaalsContact O-CD 3.3Å; D95-R99 WeakPolarHBondContact O-CD 3.49Å; D95-R99 WeakPolarHBondContact O-CG 3.3Å; D95-R99 PolarHBondContact O-N 2.62Å; D95-R99 IonicContact OD2-CZ 3.92Å; D95-R99 IonicContact OD2-NE 2.7Å; D95-R99 IonicContact OD2-NH2 2.81Å; D95-R99 PolarHBondContact OD2-NH2 3.47Å; E96-R99 PolarHBondContact O-N 2.79Å; R99-L103 WeakPolarHBondContact O-CB 3.33Å; R99-L103 WeakPolarHBondContact O-CG 3.35Å; R99-L103 PolarHBondContact O-N 2.97Å
100	V	77.3	Confident	73	Confident	35 Å²	35	91.4 Å²	91.4	21%	0.212	48%	0.479	C	S	.	.	H	α-helix	trans	-65.1	-46.6	175	169	0	0	0	0	110.3	E96 H97 G98 D102 L103 R104 F139	E96-V100 WeakPolarHBondContact O-CB 3.37Å; E96-V100 VanDerWaalsContact O-CG2 3.23Å; E96-V100 WeakPolarHBondContact O-CG2 3.45Å; E96-V100 PolarHBondContact O-N 2.77Å; H97-V100 PolarHBondContact O-N 3.05Å; G98-V100 VanDerWaalsContact C-N 3.3Å; G98-V100 PolarHBondContact O-N 2.57Å; V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 2.86Å; V100-L103 WeakPolarHBondContact O-CB 3.34Å; V100-L103 PolarHBondContact O-N 3.45Å; V100-L103 VanDerWaalsContact O-N 3.15Å; V100-R104 HydrophobicContact CG1-CG 4.32Å; V100-R104 WeakPolarHBondContact O-CG 3.45Å; V100-R104 PolarHBondContact O-N 2.9Å; V100-F139 HydrophobicContact CG1-CD1 4.36Å; V100-F139 HydrophobicContact CG1-CD2 4.33Å; V100-F139 HydrophobicContact CG1-CE1 4.3Å; V100-F139 HydrophobicContact CG1-CE2 4.21Å; V100-F139 HydrophobicContact CG1-CG 4.38Å; V100-F139 HydrophobicContact CG1-CZ 4.23Å
101	D	80	Confident	74.7	Confident	86 Å²	86	84.6 Å²	84.6	46%	0.46	44%	0.443	S	S	.	.	H	α-helix	trans	-64.7	-35	178.9	-73.2	-23.3	0	0	0	112.7	H97 G98 R104 G105	H97-D101 WeakPolarHBondContact O-CB 3.39Å; H97-D101 PolarHBondContact O-N 3.17Å; G98-D101 PolarHBondContact O-N 3.23Å; D101-R104 WeakPolarHBondContact O-CB 3.38Å; D101-R104 PolarHBondContact O-N 3.31Å; D101-R104 IonicContact OD1-CZ 3.72Å; D101-R104 IonicContact OD1-NE 3.29Å; D101-R104 IonicContact OD1-NH1 3.41Å; D101-R104 PolarHBondContact OD1-NH1 3.05Å; D101-G105 PolarHBondContact O-N 3.39Å
102	D	80.4	Confident	76.4	Confident	133 Å²	133	84.7 Å²	84.7	71%	0.711	44%	0.444	S	S	*	.	H	α-helix	trans	-65.8	-41.7	171.1	-72.6	-25.6	0	0	0	112	G98 V100 R104 G105	G98-D102 WeakPolarHBondContact O-CB 3.41Å; G98-D102 VanDerWaalsContact O-CG 3.28Å; G98-D102 PolarHBondContact O-N 3.07Å; V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 2.86Å; D102-R104 VanDerWaalsContact C-N 3.34Å; D102-G105 PolarHBondContact O-N 3.13Å
103	L	79.9	Confident	78.1	Confident	103 Å²	103	81.1 Å²	81.1	54%	0.539	43%	0.43	S	S	.	.	H	α-helix	trans	-67.7	-33.4	176.3	-76.3	169.9	0	0	0	112.7	R99 V100 G105 N154	R99-L103 WeakPolarHBondContact O-CB 3.33Å; R99-L103 WeakPolarHBondContact O-CG 3.35Å; R99-L103 PolarHBondContact O-N 2.97Å; V100-L103 WeakPolarHBondContact O-CB 3.34Å; V100-L103 PolarHBondContact O-N 3.45Å; V100-L103 VanDerWaalsContact O-N 3.15Å; L103-G105 VanDerWaalsContact C-N 3.31Å; L103-N154 PolarHBondContact O-ND2 2.88Å
104	R	79.8	Confident	79.8	Confident	87 Å²	87	79.5 Å²	79.5	33%	0.328	42%	0.423	S	S	.	.	H	α-helix	trans	-61	-45.8	173.7	-72.5	175.5	177	-173.3	-3.7	110	V100 D101 D102 M108 F139 N154 I161	V100-R104 HydrophobicContact CG1-CG 4.32Å; V100-R104 WeakPolarHBondContact O-CG 3.45Å; V100-R104 PolarHBondContact O-N 2.9Å; D101-R104 WeakPolarHBondContact O-CB 3.38Å; D101-R104 PolarHBondContact O-N 3.31Å; D101-R104 IonicContact OD1-CZ 3.72Å; D101-R104 IonicContact OD1-NE 3.29Å; D101-R104 IonicContact OD1-NH1 3.41Å; D101-R104 PolarHBondContact OD1-NH1 3.05Å; D102-R104 VanDerWaalsContact C-N 3.34Å; R104-M108 HydrophobicContact CB-CE 3.65Å; R104-M108 HydrophobicContact CG-CE 3.96Å; R104-F139 HydrophobicContact CG-CE2 4.19Å; R104-F139 HydrophobicContact CG-CZ 3.94Å; R104-N154 PolarHBondContact O-ND2 3.01Å; R104-I161 HydrophobicContact CB-CD1 4.36Å; R104-I161 HydrophobicContact CB-CG2 4.19Å; R104-I161 HydrophobicContact CG-CG2 3.57Å; R104-I161 WeakPolarHBondContact O-CD1 3.42Å
105	G	77.1	Confident	81.5	Confident	15 Å²	15	76.9 Å²	76.9	16%	0.155	41%	0.411	C	S	.	.			trans	69.3	146.4	-176.5	0	0	0	0	0	112.1	D101 D102 L103	D101-G105 PolarHBondContact O-N 3.39Å; D102-G105 PolarHBondContact O-N 3.13Å; L103-G105 VanDerWaalsContact C-N 3.31Å
106	S	83.3	Confident	82.7	Confident	112 Å²	112	75.3 Å²	75.3	78%	0.783	40%	0.403	S	S	*	.	S	Bend	trans	-113.8	129.4	172.4	-68.2	0	0	0	0	108.6	H155	S106-H155 PolarHBondContact O-CE1 2.98Å; S106-H155 VanDerWaalsContact O-CE1 3.24Å
107	P	87	Confident	83.8	Confident	88 Å²	88	72.7 Å²	72.7	57%	0.571	39%	0.392	S	S	*	.	S	Bend	cis	-82.2	158.1	4.4	33.7	-35.7	0	0	0	113.9	H155	P107-H155 HydrophobicContact CG-CB 4.28Å; P107-H155 WeakPolarHBondContact O-CB 3.43Å; P107-H155 PolarHBondContact O-ND1 3.35Å
108	M	86.8	Confident	84.6	Confident	80 Å²	80	69.6 Å²	69.6	39%	0.394	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.1	166.5	-64.9	172.2	171	0	0	109	R104 L152 I161	R104-M108 HydrophobicContact CB-CE 3.65Å; R104-M108 HydrophobicContact CG-CE 3.96Å; M108-L152 HydrophobicContact SD-CD1 4.14Å; M108-I161 HydrophobicContact CE-CG2 4.29Å; M108-I161 HydrophobicContact CG-CD1 4.31Å
109	A	89	Confident	84.9	Confident	37 Å²	37	74.1 Å²	74.1	31%	0.306	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	151.1	172.7	0	0	0	0	0	110	L152 L153	A109-L152 CarbonylContact O-C 3.47Å; A109-L152 WeakPolarHBondContact O-CA 3.3Å; A109-L153 HydrophobicContact CB-CB 4.29Å; A109-L153 PolarHBondContact N-O 2.94Å; A109-L153 PolarHBondContact O-N 3.42Å
110	V	90.2	Very high	85.5	Confident	77 Å²	77	70.9 Å²	70.9	47%	0.467	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	133.2	173.1	-176.7	0	0	0	0	108.5	L152	V110-L152 HydrophobicContact CG2-CD2 4.37Å
111	G	90.2	Very high	86.1	Confident	2 Å²	2	71.3 Å²	71.3	2%	0.021	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	171.4	171.8	0	0	0	0	0	111.2	S125 T150 V151	G111-S125 CarbonylContact C-O 3.57Å; G111-S125 WeakPolarHBondContact CA-O 3.26Å; G111-T150 CarbonylContact O-C 3.52Å; G111-T150 WeakPolarHBondContact O-CA 3.45Å; G111-V151 PolarHBondContact N-O 3.45Å; G111-V151 WeakPolarHBondContact O-CG2 3.47Å; G111-V151 PolarHBondContact O-N 3.39Å
112	N	90.9	Very high	86.7	Confident	78 Å²	78	67.2 Å²	67.2	42%	0.417	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135	176	-65.5	-16	0	0	0	109.1	E114 V124 S125	N112-E114 PolarHBondContact O-N 3.04Å; N112-V124 CarbonylContact O-C 3.49Å; N112-V124 VanDerWaalsContact O-CA 3.29Å; N112-V124 WeakPolarHBondContact O-CA 3.37Å; N112-S125 PolarHBondContact N-O 3.31Å; N112-S125 PolarHBondContact O-N 3.45Å
113	L	90.6	Very high	87.3	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.7	172.8	-170	71.2	0	0	0	109	V116 A122 V124 L145 G148 C149 V151	L113-V116 HydrophobicContact CD1-CG2 4.33Å; L113-V116 HydrophobicContact CD2-CG2 3.68Å; L113-V116 HydrophobicContact CG-CG2 4.24Å; L113-A122 HydrophobicContact CD1-CB 3.48Å; L113-A122 VanDerWaalsContact CD1-CB 3.48Å; L113-V124 HydrophobicContact CD1-CG1 3.91Å; L113-L145 HydrophobicContact CD2-CB 3.84Å; L113-L145 HydrophobicContact CD2-CD2 3.91Å; L113-L145 HydrophobicContact CD2-CG 4.45Å; L113-G148 PolarHBondContact O-N 3.4Å; L113-C149 WeakPolarHBondContact CB-O 3.3Å; L113-C149 PolarHBondContact N-O 3.11Å; L113-V151 HydrophobicContact CB-CG1 4.06Å
114	E	89.6	Confident	87.9	Confident	88 Å²	88	57.8 Å²	57.8	41%	0.411	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-51.7	178	-65.4	-163.2	167	0	0	111.4	N112 I123 S125	N112-E114 PolarHBondContact O-N 3.04Å; E114-I123 HydrophobicContact CB-CG2 4.42Å; E114-I123 PolarHBondContact N-O 3.13Å; E114-S125 WeakPolarHBondContact CG-OG 3.33Å; E114-S125 WeakPolarHBondContact OE1-CB 3.47Å; E114-S125 PolarHBondContact OE1-OG 2.94Å
115	E	90.4	Very high	88.5	Confident	119 Å²	119	54.1 Å²	54.1	56%	0.556	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.5	136	-176.7	-170	174.2	-178.9	0	0	110.3	A122 I123	E115-A122 WeakPolarHBondContact O-CA 3.45Å; E115-I123 PolarHBondContact N-O 3.04Å; E115-I123 PolarHBondContact O-N 2.98Å
116	V	88.6	Confident	89.1	Confident	26 Å²	26	54.5 Å²	54.5	16%	0.158	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.2	170.5	-177.7	0	0	0	0	107.6	L113 D118 L145	L113-V116 HydrophobicContact CD1-CG2 4.33Å; L113-V116 HydrophobicContact CD2-CG2 3.68Å; L113-V116 HydrophobicContact CG-CG2 4.24Å; V116-D118 WeakPolarHBondContact CG1-O 3.31Å; V116-L145 HydrophobicContact CG2-CB 4.48Å
117	I	89.4	Confident	89.2	Confident	72 Å²	72	54.9 Å²	54.9	37%	0.369	31%	0.31	S	S	.	.			trans	-84.2	-50.8	-176.4	-68.3	172.5	0	0	0	110.1	H121 I123 Y133	I117-H121 PolarHBondContact N-O 3.33Å; I117-H121 VanDerWaalsContact N-O 3.16Å; I117-I123 HydrophobicContact CD1-CD1 3.81Å; I117-I123 HydrophobicContact CD1-CG1 3.64Å; I117-I123 HydrophobicContact CG1-CD1 4.41Å; I117-I123 HydrophobicContact CG1-CG1 4.31Å; I117-Y133 HydrophobicContact CD1-CD2 3.61Å; I117-Y133 HydrophobicContact CD1-CE2 3.44Å; I117-Y133 VanDerWaalsContact CD1-CE2 3.44Å
118	D	86	Confident	89.3	Confident	63 Å²	63	56.7 Å²	56.7	34%	0.337	32%	0.319	S	S	.	.	S	Bend	trans	-145.4	-173.8	-178.5	68.2	17.7	0	0	0	111	V116 T120 H121	V116-D118 WeakPolarHBondContact CG1-O 3.31Å; D118-T120 PolarHBondContact O-N 3.39Å; D118-T120 VanDerWaalsContact O-N 3.16Å; D118-T120 PolarHBondContact OD1-N 3.49Å; D118-T120 PolarHBondContact OD1-OG1 3.5Å; D118-H121 PolarHBondContact N-O 3.38Å; D118-H121 WeakPolarHBondContact OD1-CA 3.42Å; D118-H121 VanDerWaalsContact OD1-CB 3.3Å; D118-H121 WeakPolarHBondContact OD1-CB 3.18Å; D118-H121 IonicContact OD1-CG 3.18Å; D118-H121 PolarHBondContact OD1-N 3.29Å; D118-H121 IonicContact OD1-ND1 2.81Å; D118-H121 PolarHBondContact OD1-ND1 2.93Å; D118-H121 VanDerWaalsContact OD1-ND1 3.08Å; D118-H121 IonicContact OD2-ND1 2.79Å; D118-H121 PolarHBondContact OD2-ND1 3.24Å; D118-H121 VanDerWaalsContact OD2-ND1 3.11Å
119	D	81.9	Confident	89.2	Confident	122 Å²	122	55.5 Å²	55.5	65%	0.652	33%	0.328	S	S	*	.	S	Bend	trans	-64.8	-13.7	-179.3	-76.8	-14.3	0	0	0	113.8	K142	D119-K142 WeakPolarHBondContact O-CE 3.49Å; D119-K142 PolarHBondContact O-NZ 3.02Å
120	T	87.1	Confident	89.3	Confident	64 Å²	64	56.2 Å²	56.2	39%	0.393	33%	0.33	S	S	.	.	S	Bend	trans	-129.2	-7.5	-172.2	50.8	0	0	0	0	113.9	D118 T135 I136	D118-T120 PolarHBondContact O-N 3.39Å; D118-T120 VanDerWaalsContact O-N 3.16Å; D118-T120 PolarHBondContact OD1-N 3.49Å; D118-T120 PolarHBondContact OD1-OG1 3.5Å; T120-T135 CarbonylContact O-C 3.48Å; T120-T135 VanDerWaalsContact O-CA 3.27Å; T120-T135 WeakPolarHBondContact O-CA 3.26Å; T120-T135 WeakPolarHBondContact O-CG2 3.48Å; T120-I136 PolarHBondContact O-N 2.64Å
121	H	90.8	Very high	89.5	Confident	43 Å²	43	58.8 Å²	58.8	20%	0.199	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.9	-175	-53.9	90.6	0	0	0	111.9	I117 D118 Y133 V134	I117-H121 PolarHBondContact N-O 3.33Å; I117-H121 VanDerWaalsContact N-O 3.16Å; D118-H121 PolarHBondContact N-O 3.38Å; D118-H121 WeakPolarHBondContact OD1-CA 3.42Å; D118-H121 VanDerWaalsContact OD1-CB 3.3Å; D118-H121 WeakPolarHBondContact OD1-CB 3.18Å; D118-H121 IonicContact OD1-CG 3.18Å; D118-H121 PolarHBondContact OD1-N 3.29Å; D118-H121 IonicContact OD1-ND1 2.81Å; D118-H121 PolarHBondContact OD1-ND1 2.93Å; D118-H121 VanDerWaalsContact OD1-ND1 3.08Å; D118-H121 IonicContact OD2-ND1 2.79Å; D118-H121 PolarHBondContact OD2-ND1 3.24Å; D118-H121 VanDerWaalsContact OD2-ND1 3.11Å; H121-Y133 HydrophobicContact CB-CE1 4.12Å; H121-Y133 HydrophobicContact CB-CE2 3.77Å; H121-Y133 VanDerWaalsContact CB-CZ 3.47Å; H121-Y133 VanDerWaalsContact CB-OH 3.28Å; H121-Y133 WeakPolarHBondContact CB-OH 3.37Å; H121-Y133 AromaticContact CD2-CE1 3.32Å; H121-Y133 WeakPolarHBondContact CD2-CE1 3.33Å; H121-Y133 AromaticContact CD2-CZ 3.48Å; H121-Y133 VanDerWaalsContact CD2-CZ 3.48Å; H121-Y133 PolarHBondContact CD2-OH 3.45Å; H121-Y133 VanDerWaalsContact CD2-OH 3.28Å; H121-Y133 AromaticContact CG-CE1 3.85Å; H121-Y133 AromaticContact CG-CZ 3.48Å; H121-Y133 VanDerWaalsContact CG-CZ 3.48Å; H121-Y133 PolarHBondContact ND1-OH 2.81Å; H121-V134 VanDerWaalsContact CA-O 3.25Å; H121-V134 WeakPolarHBondContact CA-O 3.32Å
122	A	91.8	Very high	89.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.8	174.4	0	0	0	0	0	111.1	L113 E115 V134 I136	L113-A122 HydrophobicContact CD1-CB 3.48Å; L113-A122 VanDerWaalsContact CD1-CB 3.48Å; E115-A122 WeakPolarHBondContact O-CA 3.45Å; A122-V134 PolarHBondContact N-O 3.46Å; A122-V134 WeakPolarHBondContact O-CG2 3.31Å; A122-V134 PolarHBondContact O-N 3.14Å; A122-I136 HydrophobicContact CB-CD1 4.16Å; A122-I136 HydrophobicContact CB-CG1 4.27Å
123	I	93.4	Very high	89.7	Confident	38 Å²	38	64.1 Å²	64.1	20%	0.195	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.4	167.5	-61.4	174	0	0	0	107.6	E114 E115 I117 E131 H132	E114-I123 HydrophobicContact CB-CG2 4.42Å; E114-I123 PolarHBondContact N-O 3.13Å; E115-I123 PolarHBondContact N-O 3.04Å; E115-I123 PolarHBondContact O-N 2.98Å; I117-I123 HydrophobicContact CD1-CD1 3.81Å; I117-I123 HydrophobicContact CD1-CG1 3.64Å; I117-I123 HydrophobicContact CG1-CD1 4.41Å; I117-I123 HydrophobicContact CG1-CG1 4.31Å; I123-E131 HydrophobicContact CG2-CB 4.23Å; I123-H132 WeakPolarHBondContact CA-O 3.37Å
124	V	92.7	Very high	89.7	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.9	176.5	-59.2	0	0	0	0	109.8	N112 L113 E131 H132 V134 V151 L153 V160	N112-V124 CarbonylContact O-C 3.49Å; N112-V124 VanDerWaalsContact O-CA 3.29Å; N112-V124 WeakPolarHBondContact O-CA 3.37Å; L113-V124 HydrophobicContact CD1-CG1 3.91Å; V124-E131 CarbonylContact O-C 3.6Å; V124-E131 WeakPolarHBondContact O-CA 3.44Å; V124-H132 HydrophobicContact CG2-CB 4.3Å; V124-H132 PolarHBondContact N-O 3.2Å; V124-H132 PolarHBondContact O-N 3.48Å; V124-V134 HydrophobicContact CB-CG2 4.18Å; V124-V134 HydrophobicContact CG1-CG2 3.61Å; V124-V134 HydrophobicContact CG2-CB 4.28Å; V124-V134 HydrophobicContact CG2-CG1 3.73Å; V124-V134 HydrophobicContact CG2-CG2 3.52Å; V124-V151 HydrophobicContact CG1-CG2 3.95Å; V124-L153 HydrophobicContact CB-CD1 4.3Å; V124-L153 HydrophobicContact CB-CD2 4.2Å; V124-L153 HydrophobicContact CG1-CD2 4.08Å; V124-L153 HydrophobicContact CG2-CD1 3.76Å; V124-L153 HydrophobicContact CG2-CD2 3.86Å; V124-L153 HydrophobicContact CG2-CG 4.49Å; V124-V160 HydrophobicContact CG1-CG2 3.91Å
125	S	92.1	Very high	89.8	Confident	11 Å²	11	63.1 Å²	63.1	8%	0.077	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.8	168.8	47.2	0	0	0	0	110.3	G111 N112 E114	G111-S125 CarbonylContact C-O 3.57Å; G111-S125 WeakPolarHBondContact CA-O 3.26Å; N112-S125 PolarHBondContact N-O 3.31Å; N112-S125 PolarHBondContact O-N 3.45Å; E114-S125 WeakPolarHBondContact CG-OG 3.33Å; E114-S125 WeakPolarHBondContact OE1-CB 3.47Å; E114-S125 PolarHBondContact OE1-OG 2.94Å
126	T	89.8	Confident	89.8	Confident	23 Å²	23	58 Å²	58	14%	0.141	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	169.3	172.9	68.9	0	0	0	0	110.4	V128 G129 S130 L153	T126-V128 PolarHBondContact O-N 3.33Å; T126-V128 PolarHBondContact OG1-N 3.37Å; T126-G129 PolarHBondContact O-N 3.32Å; T126-S130 PolarHBondContact N-O 2.88Å; T126-S130 PolarHBondContact OG1-O 2.98Å; T126-S130 PolarHBondContact OG1-OG 3.45Å; T126-L153 HydrophobicContact CG2-CD1 4.42Å
127	S	85.3	Confident	89.7	Confident	119 Å²	119	58.7 Å²	58.7	83%	0.832	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.7	174.8	55.8	0	0	0	0	114.7	G129	S127-G129 VanDerWaalsContact C-N 3.32Å
128	V	88.7	Confident	89.4	Confident	127 Å²	127	61.4 Å²	61.4	77%	0.77	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-9.1	176.2	-171.2	0	0	0	0	111.8	T126	T126-V128 PolarHBondContact O-N 3.33Å; T126-V128 PolarHBondContact OG1-N 3.37Å
129	G	86	Confident	89.2	Confident	55 Å²	55	61.8 Å²	61.8	57%	0.567	36%	0.357	S	S	*	.	S	Bend	trans	83.9	11	-175.5	0	0	0	0	0	114	T126 S127	T126-G129 PolarHBondContact O-N 3.32Å; S127-G129 VanDerWaalsContact C-N 3.32Å
130	S	91.1	Very high	89.3	Confident	51 Å²	51	56.6 Å²	56.6	36%	0.357	33%	0.329	S	S	.	.			trans	-83.4	123.1	172.1	48.8	0	0	0	0	111	T126 H132	T126-S130 PolarHBondContact N-O 2.88Å; T126-S130 PolarHBondContact OG1-O 2.98Å; T126-S130 PolarHBondContact OG1-OG 3.45Å; S130-H132 PolarHBondContact O-ND1 3.1Å; S130-H132 VanDerWaalsContact O-ND1 3.12Å; S130-H132 PolarHBondContact OG-CE1 3.38Å; S130-H132 VanDerWaalsContact OG-CE1 3.28Å
131	E	93	Very high	89	Confident	131 Å²	131	57.4 Å²	57.4	61%	0.612	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.5	176.8	-65.5	164.9	-154.2	0	0	110.4	I123 V124	I123-E131 HydrophobicContact CG2-CB 4.23Å; V124-E131 CarbonylContact O-C 3.6Å; V124-E131 WeakPolarHBondContact O-CA 3.44Å
132	H	91.7	Very high	88.7	Confident	56 Å²	56	59.5 Å²	59.5	26%	0.259	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.7	177.2	-61.2	81	0	0	0	110	I123 V124 S130 V134	I123-H132 WeakPolarHBondContact CA-O 3.37Å; V124-H132 HydrophobicContact CG2-CB 4.3Å; V124-H132 PolarHBondContact N-O 3.2Å; V124-H132 PolarHBondContact O-N 3.48Å; S130-H132 PolarHBondContact O-ND1 3.1Å; S130-H132 VanDerWaalsContact O-ND1 3.12Å; S130-H132 PolarHBondContact OG-CE1 3.38Å; S130-H132 VanDerWaalsContact OG-CE1 3.28Å; H132-V134 HydrophobicContact CB-CG1 3.62Å; H132-V134 PolarHBondContact O-N 3.1Å
133	Y	93	Very high	88.3	Confident	136 Å²	136	65.6 Å²	65.6	53%	0.533	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.1	167.1	-179.8	-94.3	0	0	0	108.8	I117 H121	I117-Y133 HydrophobicContact CD1-CD2 3.61Å; I117-Y133 HydrophobicContact CD1-CE2 3.44Å; I117-Y133 VanDerWaalsContact CD1-CE2 3.44Å; H121-Y133 HydrophobicContact CB-CE1 4.12Å; H121-Y133 HydrophobicContact CB-CE2 3.77Å; H121-Y133 VanDerWaalsContact CB-CZ 3.47Å; H121-Y133 VanDerWaalsContact CB-OH 3.28Å; H121-Y133 WeakPolarHBondContact CB-OH 3.37Å; H121-Y133 AromaticContact CD2-CE1 3.32Å; H121-Y133 WeakPolarHBondContact CD2-CE1 3.33Å; H121-Y133 AromaticContact CD2-CZ 3.48Å; H121-Y133 VanDerWaalsContact CD2-CZ 3.48Å; H121-Y133 PolarHBondContact CD2-OH 3.45Å; H121-Y133 VanDerWaalsContact CD2-OH 3.28Å; H121-Y133 AromaticContact CG-CE1 3.85Å; H121-Y133 AromaticContact CG-CZ 3.48Å; H121-Y133 VanDerWaalsContact CG-CZ 3.48Å; H121-Y133 PolarHBondContact ND1-OH 2.81Å
134	V	92.3	Very high	87.7	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.03	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.4	-167.3	-60	0	0	0	0	111.5	H121 A122 V124 H132 H158 V160	H121-V134 VanDerWaalsContact CA-O 3.25Å; H121-V134 WeakPolarHBondContact CA-O 3.32Å; A122-V134 PolarHBondContact N-O 3.46Å; A122-V134 WeakPolarHBondContact O-CG2 3.31Å; A122-V134 PolarHBondContact O-N 3.14Å; V124-V134 HydrophobicContact CB-CG2 4.18Å; V124-V134 HydrophobicContact CG1-CG2 3.61Å; V124-V134 HydrophobicContact CG2-CB 4.28Å; V124-V134 HydrophobicContact CG2-CG1 3.73Å; V124-V134 HydrophobicContact CG2-CG2 3.52Å; H132-V134 HydrophobicContact CB-CG1 3.62Å; H132-V134 PolarHBondContact O-N 3.1Å; V134-H158 VanDerWaalsContact CB-O 3.23Å; V134-H158 WeakPolarHBondContact CB-O 3.42Å; V134-H158 HydrophobicContact CG1-CB 3.7Å; V134-H158 WeakPolarHBondContact CG1-O 3.44Å; V134-V160 HydrophobicContact CG2-CG2 3.8Å
135	T	92	Very high	87.3	Confident	64 Å²	64	68.8 Å²	68.8	39%	0.393	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.3	175	-50.5	0	0	0	0	110.7	T120 S159 V160	T120-T135 CarbonylContact O-C 3.48Å; T120-T135 VanDerWaalsContact O-CA 3.27Å; T120-T135 WeakPolarHBondContact O-CA 3.26Å; T120-T135 WeakPolarHBondContact O-CG2 3.48Å; T135-S159 CarbonylContact O-C 3.59Å; T135-S159 VanDerWaalsContact O-CA 3.32Å; T135-S159 WeakPolarHBondContact O-CA 3.4Å; T135-S159 WeakPolarHBondContact O-CB 3.41Å; T135-V160 PolarHBondContact O-N 2.82Å
136	I	90.1	Very high	86.9	Confident	13 Å²	13	72.2 Å²	72.2	7%	0.067	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-85.4	122.6	172.2	-54.4	167.7	0	0	0	108.6	T120 A122 V140 L145 V160	T120-I136 PolarHBondContact O-N 2.64Å; A122-I136 HydrophobicContact CB-CD1 4.16Å; A122-I136 HydrophobicContact CB-CG1 4.27Å; I136-V140 HydrophobicContact CG2-CB 3.94Å; I136-V140 HydrophobicContact CG2-CG1 4.33Å; I136-V140 HydrophobicContact CG2-CG2 4.33Å; I136-L145 HydrophobicContact CD1-CD1 3.88Å; I136-L145 HydrophobicContact CG1-CD1 4.47Å; I136-L145 HydrophobicContact CG2-CD1 4.07Å; I136-V160 HydrophobicContact CG1-CB 4.46Å
137	L	86.7	Confident	86.7	Confident	39 Å²	39	75.3 Å²	75.3	20%	0.204	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-72.9	149	178.4	-63.7	177.7	0	0	0	111.5	F139 V140 V160 I161	L137-F139 HydrophobicContact CB-CD1 3.96Å; L137-F139 HydrophobicContact CB-CE1 3.56Å; L137-F139 HydrophobicContact CB-CZ 4.03Å; L137-F139 HydrophobicContact CD1-CE1 3.59Å; L137-F139 HydrophobicContact CD1-CZ 3.63Å; L137-F139 HydrophobicContact CG-CE1 4.17Å; L137-F139 HydrophobicContact CG-CZ 4.48Å; L137-F139 PolarHBondContact O-N 2.7Å; L137-V140 WeakPolarHBondContact O-CG2 3.32Å; L137-V140 PolarHBondContact O-N 2.82Å; L137-V140 VanDerWaalsContact O-N 3.09Å; L137-V160 WeakPolarHBondContact CB-O 3.34Å; L137-V160 WeakPolarHBondContact CG-O 3.34Å; L137-V160 PolarHBondContact N-O 2.92Å; L137-I161 HydrophobicContact CD1-CG1 4.12Å
138	S	82.3	Confident	86.6	Confident	129 Å²	129	72.3 Å²	72.3	90%	0.902	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-18.5	-170.6	-50.9	0	0	0	0	115.5	V140	S138-V140 VanDerWaalsContact C-N 3.32Å
139	F	81.9	Confident	86.4	Confident	72 Å²	72	67 Å²	67	32%	0.316	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.5	179.9	57.6	-92.9	0	0	0	113.4	V100 R104 L137 I161	V100-F139 HydrophobicContact CG1-CD1 4.36Å; V100-F139 HydrophobicContact CG1-CD2 4.33Å; V100-F139 HydrophobicContact CG1-CE1 4.3Å; V100-F139 HydrophobicContact CG1-CE2 4.21Å; V100-F139 HydrophobicContact CG1-CG 4.38Å; V100-F139 HydrophobicContact CG1-CZ 4.23Å; R104-F139 HydrophobicContact CG-CE2 4.19Å; R104-F139 HydrophobicContact CG-CZ 3.94Å; L137-F139 HydrophobicContact CB-CD1 3.96Å; L137-F139 HydrophobicContact CB-CE1 3.56Å; L137-F139 HydrophobicContact CB-CZ 4.03Å; L137-F139 HydrophobicContact CD1-CE1 3.59Å; L137-F139 HydrophobicContact CD1-CZ 3.63Å; L137-F139 HydrophobicContact CG-CE1 4.17Å; L137-F139 HydrophobicContact CG-CZ 4.48Å; L137-F139 PolarHBondContact O-N 2.7Å; F139-I161 WeakPolarHBondContact CD2-O 3.34Å; F139-I161 HydrophobicContact CE2-CG2 3.81Å; F139-I161 WeakPolarHBondContact CE2-O 3.36Å; F139-I161 HydrophobicContact CZ-CG2 3.99Å
140	V	82.7	Confident	86.4	Confident	12 Å²	12	65.6 Å²	65.6	7%	0.073	36%	0.358	C	S	.	.	S	Bend	trans	-87.1	128.8	173.4	-173.2	0	0	0	0	109.8	I136 L137 S138 K142 L145 V160 I161 V163	I136-V140 HydrophobicContact CG2-CB 3.94Å; I136-V140 HydrophobicContact CG2-CG1 4.33Å; I136-V140 HydrophobicContact CG2-CG2 4.33Å; L137-V140 WeakPolarHBondContact O-CG2 3.32Å; L137-V140 PolarHBondContact O-N 2.82Å; L137-V140 VanDerWaalsContact O-N 3.09Å; S138-V140 VanDerWaalsContact C-N 3.32Å; V140-K142 PolarHBondContact O-N 3.42Å; V140-L145 HydrophobicContact CG1-CD1 4.12Å; V140-L145 HydrophobicContact CG1-CD2 4.34Å; V140-L145 HydrophobicContact CG1-CG 4.27Å; V140-V160 HydrophobicContact CG2-CG1 4.4Å; V140-I161 WeakPolarHBondContact CG2-O 3.24Å; V140-V163 HydrophobicContact CG1-CG2 4.16Å
141	D	82.2	Confident	86.4	Confident	81 Å²	81	63.1 Å²	63.1	43%	0.433	34%	0.341	S	S	.	.			trans	-74.1	111.1	172.1	-171	3.2	0	0	0	109.9	D143 Q144	D141-D143 PolarHBondContact O-N 3.5Å; D141-D143 PolarHBondContact OD1-N 3.05Å; D141-Q144 HydrophobicContact CB-CG 4.11Å; D141-Q144 PolarHBondContact O-N 3.11Å; D141-Q144 PolarHBondContact OD2-NE2 3.38Å
142	K	83.6	Confident	86.3	Confident	87 Å²	87	58.7 Å²	58.7	38%	0.378	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-67	-24.5	-175	-58.9	179.3	-166.6	-175.6	0	112.6	D119 V140 Q144 L145	D119-K142 WeakPolarHBondContact O-CE 3.49Å; D119-K142 PolarHBondContact O-NZ 3.02Å; V140-K142 PolarHBondContact O-N 3.42Å; K142-Q144 PolarHBondContact O-N 2.91Å; K142-L145 PolarHBondContact O-N 3.36Å
143	D	83.1	Confident	86.3	Confident	128 Å²	128	56 Å²	56	68%	0.684	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-69.7	-16.3	179	-70.7	-19	0	0	0	112.1	D141	D141-D143 PolarHBondContact O-N 3.5Å; D141-D143 PolarHBondContact OD1-N 3.05Å
144	Q	82.1	Confident	86.1	Confident	103 Å²	103	50.3 Å²	50.3	48%	0.481	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-93.5	-6.6	178.4	-58.4	-179.7	21.6	0	0	113.1	D141 K142 E146 V163	D141-Q144 HydrophobicContact CB-CG 4.11Å; D141-Q144 PolarHBondContact O-N 3.11Å; D141-Q144 PolarHBondContact OD2-NE2 3.38Å; K142-Q144 PolarHBondContact O-N 2.91Å; Q144-E146 PolarHBondContact O-N 3.11Å; Q144-V163 HydrophobicContact CB-CG2 4.37Å
145	L	83.6	Confident	85.8	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	30%	0.301	C	S	.	.			trans	-86	94.2	-179.3	-70.2	171.3	0	0	0	110.3	F34 L113 V116 I136 V140 K142 V151 V160 V163	F34-L145 WeakPolarHBondContact CE1-O 3.2Å; L113-L145 HydrophobicContact CD2-CB 3.84Å; L113-L145 HydrophobicContact CD2-CD2 3.91Å; L113-L145 HydrophobicContact CD2-CG 4.45Å; V116-L145 HydrophobicContact CG2-CB 4.48Å; I136-L145 HydrophobicContact CD1-CD1 3.88Å; I136-L145 HydrophobicContact CG1-CD1 4.47Å; I136-L145 HydrophobicContact CG2-CD1 4.07Å; V140-L145 HydrophobicContact CG1-CD1 4.12Å; V140-L145 HydrophobicContact CG1-CD2 4.34Å; V140-L145 HydrophobicContact CG1-CG 4.27Å; K142-L145 PolarHBondContact O-N 3.36Å; L145-V151 HydrophobicContact CD2-CG1 3.84Å; L145-V160 HydrophobicContact CD2-CG1 4.49Å; L145-V163 HydrophobicContact CD2-CG2 3.34Å; L145-V163 HydrophobicContact CG-CG2 3.98Å
146	E	82.9	Confident	85.6	Confident	84 Å²	84	58.1 Å²	58.1	39%	0.393	32%	0.317	S	S	.	.			trans	-101.8	143.8	170.1	-60.4	-175.9	162.2	0	0	110.6	Q144 G148 C149	Q144-E146 PolarHBondContact O-N 3.11Å; E146-G148 PolarHBondContact O-N 3.17Å; E146-C149 VanDerWaalsContact O-CB 3.23Å; E146-C149 WeakPolarHBondContact O-CB 3.43Å; E146-C149 PolarHBondContact O-N 3.38Å; E146-C149 PolarHBondContact O-SG 3.47Å; E146-C149 VanDerWaalsContact O-SG 3.4Å
147	P	85.7	Confident	85.5	Confident	88 Å²	88	61.5 Å²	61.5	57%	0.571	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	127.5	169.9	-27.5	36.2	0	0	0	111.3
148	G	83	Confident	85.5	Confident	55 Å²	55	62.5 Å²	62.5	57%	0.567	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-6.9	-175.4	0	0	0	0	0	115.2	L113 E146	L113-G148 PolarHBondContact O-N 3.4Å; E146-G148 PolarHBondContact O-N 3.17Å
149	C	84.6	Confident	85.9	Confident	17 Å²	17	57.1 Å²	57.1	12%	0.115	30%	0.304	C	S	.	.			trans	-65.5	142.6	170.4	-75.3	0	0	0	0	110.9	L113 E146 V163	L113-C149 WeakPolarHBondContact CB-O 3.3Å; L113-C149 PolarHBondContact N-O 3.11Å; E146-C149 VanDerWaalsContact O-CB 3.23Å; E146-C149 WeakPolarHBondContact O-CB 3.43Å; E146-C149 PolarHBondContact O-N 3.38Å; E146-C149 PolarHBondContact O-SG 3.47Å; E146-C149 VanDerWaalsContact O-SG 3.4Å; C149-V163 HydrophobicContact CB-CG1 4.28Å
150	T	87.9	Confident	86.2	Confident	24 Å²	24	53.7 Å²	53.7	15%	0.147	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133	168.7	80	0	0	0	0	109.9	G111 L164 D167	G111-T150 CarbonylContact O-C 3.52Å; G111-T150 WeakPolarHBondContact O-CA 3.45Å; T150-L164 PolarHBondContact O-N 3.5Å; T150-L164 VanDerWaalsContact OG1-CB 3.28Å; T150-L164 WeakPolarHBondContact OG1-CB 3.42Å; T150-D167 WeakPolarHBondContact CB-OD1 3.35Å; T150-D167 WeakPolarHBondContact CG2-OD1 3.19Å; T150-D167 WeakPolarHBondContact CG2-OD2 3.42Å; T150-D167 PolarHBondContact N-OD2 3.41Å; T150-D167 VanDerWaalsContact OG1-CG 3.25Å; T150-D167 PolarHBondContact OG1-OD1 3.23Å; T150-D167 PolarHBondContact OG1-OD2 2.94Å
151	V	91	Very high	86.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	147	-175.9	-68.7	0	0	0	0	110	G111 L113 V124 L145 L153 V160 G162 V163	G111-V151 PolarHBondContact N-O 3.45Å; G111-V151 WeakPolarHBondContact O-CG2 3.47Å; G111-V151 PolarHBondContact O-N 3.39Å; L113-V151 HydrophobicContact CB-CG1 4.06Å; V124-V151 HydrophobicContact CG1-CG2 3.95Å; L145-V151 HydrophobicContact CD2-CG1 3.84Å; V151-L153 HydrophobicContact CG2-CD2 3.82Å; V151-L153 HydrophobicContact CG2-CG 4.39Å; V151-V160 HydrophobicContact CB-CG1 4.11Å; V151-V160 HydrophobicContact CG1-CG1 4.25Å; V151-G162 CarbonylContact C-O 3.55Å; V151-G162 WeakPolarHBondContact CA-O 3.47Å; V151-V163 HydrophobicContact CG1-CG2 4.49Å
152	L	90.5	Very high	86.6	Confident	37 Å²	37	50.2 Å²	50.2	19%	0.194	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	126.8	172.6	-59.9	177.1	0	0	0	108.8	M108 A109 V110 I161 G162	M108-L152 HydrophobicContact SD-CD1 4.14Å; A109-L152 CarbonylContact O-C 3.47Å; A109-L152 WeakPolarHBondContact O-CA 3.3Å; V110-L152 HydrophobicContact CG2-CD2 4.37Å; L152-I161 HydrophobicContact CB-CB 4.2Å; L152-I161 WeakPolarHBondContact O-CB 3.34Å; L152-I161 PolarHBondContact O-N 3.35Å; L152-G162 PolarHBondContact N-O 3.28Å
153	L	90.7	Very high	86.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.9	-177.7	-55.1	-179.8	0	0	0	110.6	A109 V124 T126 V151 S159 V160	A109-L153 HydrophobicContact CB-CB 4.29Å; A109-L153 PolarHBondContact N-O 2.94Å; A109-L153 PolarHBondContact O-N 3.42Å; V124-L153 HydrophobicContact CB-CD1 4.3Å; V124-L153 HydrophobicContact CB-CD2 4.2Å; V124-L153 HydrophobicContact CG1-CD2 4.08Å; V124-L153 HydrophobicContact CG2-CD1 3.76Å; V124-L153 HydrophobicContact CG2-CD2 3.86Å; V124-L153 HydrophobicContact CG2-CG 4.49Å; T126-L153 HydrophobicContact CG2-CD1 4.42Å; V151-L153 HydrophobicContact CG2-CD2 3.82Å; V151-L153 HydrophobicContact CG2-CG 4.39Å; L153-S159 WeakPolarHBondContact CA-O 3.31Å; L153-V160 HydrophobicContact CD2-CG2 3.91Å
154	N	89.9	Confident	86.8	Confident	16 Å²	16	45 Å²	45	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	131	170.9	-170.5	-41.6	0	0	0	110.3	L103 R104 K156 H158 S159 I161	L103-N154 PolarHBondContact O-ND2 2.88Å; R104-N154 PolarHBondContact O-ND2 3.01Å; N154-K156 PolarHBondContact O-N 3.31Å; N154-K156 PolarHBondContact OD1-N 2.86Å; N154-H158 WeakPolarHBondContact O-CA 3.46Å; N154-H158 PolarHBondContact O-N 3.07Å; N154-S159 PolarHBondContact N-O 3.43Å; N154-I161 HydrophobicContact CB-CD1 3.83Å; N154-I161 HydrophobicContact CB-CG1 4.22Å
155	H	86.4	Confident	86.3	Confident	67 Å²	67	44.8 Å²	44.8	31%	0.31	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-21	-179.8	69.2	-85	0	0	0	114.8	S106 P107	S106-H155 PolarHBondContact O-CE1 2.98Å; S106-H155 VanDerWaalsContact O-CE1 3.24Å; P107-H155 HydrophobicContact CG-CB 4.28Å; P107-H155 WeakPolarHBondContact O-CB 3.43Å; P107-H155 PolarHBondContact O-ND1 3.35Å
156	K	86.8	Confident	85.5	Confident	166 Å²	166	50.4 Å²	50.4	72%	0.722	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-46.1	-179.5	-60.8	-173.2	-179.4	171.9	0	113.2	N154	N154-K156 PolarHBondContact O-N 3.31Å; N154-K156 PolarHBondContact OD1-N 2.86Å
157	T	87.1	Confident	84.7	Confident	85 Å²	85	48.9 Å²	48.9	52%	0.521	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-7.7	-171.9	59.7	0	0	0	0	113.2	S159	T157-S159 WeakPolarHBondContact CB-OG 3.34Å; T157-S159 PolarHBondContact O-N 2.84Å; T157-S159 WeakPolarHBondContact OG1-CB 3.36Å; T157-S159 PolarHBondContact OG1-N 3.01Å; T157-S159 PolarHBondContact OG1-OG 3.24Å
158	H	87.4	Confident	83.8	Confident	60 Å²	60	46.6 Å²	46.6	28%	0.278	27%	0.269	S	S	.	.			trans	56.6	13.1	-170.5	-60.6	-72.9	0	0	0	114.5	V134 N154	V134-H158 VanDerWaalsContact CB-O 3.23Å; V134-H158 WeakPolarHBondContact CB-O 3.42Å; V134-H158 HydrophobicContact CG1-CB 3.7Å; V134-H158 WeakPolarHBondContact CG1-O 3.44Å; N154-H158 WeakPolarHBondContact O-CA 3.46Å; N154-H158 PolarHBondContact O-N 3.07Å
159	S	89.9	Confident	83.2	Confident	16 Å²	16	46.3 Å²	46.3	11%	0.112	26%	0.255	C	S	.	.			trans	-64.4	144.3	178.7	-51.2	0	0	0	0	112	T135 L153 N154 T157 I161	T135-S159 CarbonylContact O-C 3.59Å; T135-S159 VanDerWaalsContact O-CA 3.32Å; T135-S159 WeakPolarHBondContact O-CA 3.4Å; T135-S159 WeakPolarHBondContact O-CB 3.41Å; L153-S159 WeakPolarHBondContact CA-O 3.31Å; N154-S159 PolarHBondContact N-O 3.43Å; T157-S159 WeakPolarHBondContact CB-OG 3.34Å; T157-S159 PolarHBondContact O-N 2.84Å; T157-S159 WeakPolarHBondContact OG1-CB 3.36Å; T157-S159 PolarHBondContact OG1-N 3.01Å; T157-S159 PolarHBondContact OG1-OG 3.24Å; S159-I161 PolarHBondContact O-N 3.4Å
160	V	89.6	Confident	82.8	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.4	177.5	-179.2	0	0	0	0	109.5	V124 V134 T135 I136 L137 V140 L145 V151 L153	V124-V160 HydrophobicContact CG1-CG2 3.91Å; V134-V160 HydrophobicContact CG2-CG2 3.8Å; T135-V160 PolarHBondContact O-N 2.82Å; I136-V160 HydrophobicContact CG1-CB 4.46Å; L137-V160 WeakPolarHBondContact CB-O 3.34Å; L137-V160 WeakPolarHBondContact CG-O 3.34Å; L137-V160 PolarHBondContact N-O 2.92Å; V140-V160 HydrophobicContact CG2-CG1 4.4Å; L145-V160 HydrophobicContact CD2-CG1 4.49Å; V151-V160 HydrophobicContact CB-CG1 4.11Å; V151-V160 HydrophobicContact CG1-CG1 4.25Å; L153-V160 HydrophobicContact CD2-CG2 3.91Å
161	I	87.6	Confident	82.1	Confident	5 Å²	5	53 Å²	53	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-35.1	179.6	-69	167.4	0	0	0	111.4	R104 M108 L137 F139 V140 L152 N154 S159	R104-I161 HydrophobicContact CB-CD1 4.36Å; R104-I161 HydrophobicContact CB-CG2 4.19Å; R104-I161 HydrophobicContact CG-CG2 3.57Å; R104-I161 WeakPolarHBondContact O-CD1 3.42Å; M108-I161 HydrophobicContact CE-CG2 4.29Å; M108-I161 HydrophobicContact CG-CD1 4.31Å; L137-I161 HydrophobicContact CD1-CG1 4.12Å; F139-I161 WeakPolarHBondContact CD2-O 3.34Å; F139-I161 HydrophobicContact CE2-CG2 3.81Å; F139-I161 WeakPolarHBondContact CE2-O 3.36Å; F139-I161 HydrophobicContact CZ-CG2 3.99Å; V140-I161 WeakPolarHBondContact CG2-O 3.24Å; L152-I161 HydrophobicContact CB-CB 4.2Å; L152-I161 WeakPolarHBondContact O-CB 3.34Å; L152-I161 PolarHBondContact O-N 3.35Å; N154-I161 HydrophobicContact CB-CD1 3.83Å; N154-I161 HydrophobicContact CB-CG1 4.22Å; S159-I161 PolarHBondContact O-N 3.4Å
162	G	86.3	Confident	81.2	Confident	14 Å²	14	53 Å²	53	14%	0.144	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	169.6	-172.6	0	0	0	0	0	111.6	V151 L152	V151-G162 CarbonylContact C-O 3.55Å; V151-G162 WeakPolarHBondContact CA-O 3.47Å; L152-G162 PolarHBondContact N-O 3.28Å
163	V	86.6	Confident	80.4	Confident	30 Å²	30	54.8 Å²	54.8	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.4	173.9	-173.9	0	0	0	0	107.9	V140 Q144 L145 C149 V151 S165	V140-V163 HydrophobicContact CG1-CG2 4.16Å; Q144-V163 HydrophobicContact CB-CG2 4.37Å; L145-V163 HydrophobicContact CD2-CG2 3.34Å; L145-V163 HydrophobicContact CG-CG2 3.98Å; C149-V163 HydrophobicContact CB-CG1 4.28Å; V151-V163 HydrophobicContact CG1-CG2 4.49Å; V163-S165 PolarHBondContact O-N 3.47Å
164	L	84.2	Confident	79.7	Confident	77 Å²	77	60.8 Å²	60.8	40%	0.403	34%	0.338	S	S	.	.			trans	-80.8	115.2	168.9	-168.3	66.7	0	0	0	107.6	T150 D166	T150-L164 PolarHBondContact O-N 3.5Å; T150-L164 VanDerWaalsContact OG1-CB 3.28Å; T150-L164 WeakPolarHBondContact OG1-CB 3.42Å; L164-D166 VanDerWaalsContact C-N 3.27Å; L164-D166 PolarHBondContact O-N 2.99Å
165	S	71.3	Confident	79.1	Confident	97 Å²	97	60.7 Å²	60.7	68%	0.678	34%	0.337	S	S	*	.	S	Bend	trans	-74.2	-16.5	-172.1	56.5	0	0	0	0	114.3	V163	V163-S165 PolarHBondContact O-N 3.47Å
166	D	66.8	Low	78.5	Confident	121 Å²	121	60.6 Å²	60.6	65%	0.647	34%	0.336	S	S	*	.			trans	-117.5	54.2	-168.7	-63.5	-10.7	0	0	0	112.1	L164 T168	L164-D166 VanDerWaalsContact C-N 3.27Å; L164-D166 PolarHBondContact O-N 2.99Å; D166-T168 PolarHBondContact O-N 2.97Å
167	D	66	Low	77.7	Confident	52 Å²	52	56.3 Å²	56.3	28%	0.278	32%	0.32	S	S	.	.			trans	-72.3	26.1	171.3	-74.3	-21.5	0	0	0	113.3	T150 D169	T150-D167 WeakPolarHBondContact CB-OD1 3.35Å; T150-D167 WeakPolarHBondContact CG2-OD1 3.19Å; T150-D167 WeakPolarHBondContact CG2-OD2 3.42Å; T150-D167 PolarHBondContact N-OD2 3.41Å; T150-D167 VanDerWaalsContact OG1-CG 3.25Å; T150-D167 PolarHBondContact OG1-OD1 3.23Å; T150-D167 PolarHBondContact OG1-OD2 2.94Å; D167-D169 PolarHBondContact O-N 3.44Å
168	T	67.2	Low	76.4	Confident	40 Å²	40	60.9 Å²	60.9	25%	0.245	34%	0.336	C	S	.	.			trans	-77.4	125.4	175.5	32.3	0	0	0	0	109.2	D166 V273	D166-T168 PolarHBondContact O-N 2.97Å; T168-V273 HydrophobicContact CG2-CG2 3.63Å
169	D	69.6	Low	75.4	Confident	49 Å²	49	66 Å²	66	26%	0.262	36%	0.357	S	S	.	.			trans	-55.7	127.9	174.4	-169.2	-38.8	0	0	0	108.3	D167 M171 V172 E269	D167-D169 PolarHBondContact O-N 3.44Å; D169-M171 PolarHBondContact O-N 3.15Å; D169-M171 WeakPolarHBondContact OD1-CB 3.36Å; D169-M171 WeakPolarHBondContact OD1-CG 3.46Å; D169-M171 PolarHBondContact OD1-N 3.25Å; D169-V172 HydrophobicContact CB-CG2 4.45Å; D169-V172 PolarHBondContact O-N 2.79Å; D169-E269 WeakPolarHBondContact CB-OE2 3.49Å
170	P	76	Confident	74.2	Confident	94 Å²	94	68.3 Å²	68.3	61%	0.61	38%	0.377	S	S	*	.	H	α-helix	trans	-52.9	-26.3	179.1	21.7	-35.1	0	0	0	112.3	V172 N173 V174	P170-V172 VanDerWaalsContact C-N 3.3Å; P170-V172 PolarHBondContact O-N 3.2Å; P170-N173 PolarHBondContact O-N 3.37Å; P170-V174 WeakPolarHBondContact O-CG2 3.27Å; P170-V174 PolarHBondContact O-N 2.97Å
171	M	72.6	Confident	73.3	Confident	87 Å²	87	69.2 Å²	69.2	43%	0.429	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-37.1	175.2	-66	-166.1	74.5	0	0	113	D169 V174 L266	D169-M171 PolarHBondContact O-N 3.15Å; D169-M171 WeakPolarHBondContact OD1-CB 3.36Å; D169-M171 WeakPolarHBondContact OD1-CG 3.46Å; D169-M171 PolarHBondContact OD1-N 3.25Å; M171-V174 WeakPolarHBondContact O-CB 3.09Å; M171-V174 PolarHBondContact O-N 3.3Å; M171-L266 HydrophobicContact CB-CD1 4.4Å
172	V	72.6	Confident	72.8	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-75.7	-31.7	-179.9	-170.9	0	0	0	0	111.2	D169 P170 V174 M175 K176 L266 E269 V273	D169-V172 HydrophobicContact CB-CG2 4.45Å; D169-V172 PolarHBondContact O-N 2.79Å; P170-V172 VanDerWaalsContact C-N 3.3Å; P170-V172 PolarHBondContact O-N 3.2Å; V172-V174 PolarHBondContact O-N 3.33Å; V172-M175 WeakPolarHBondContact O-CB 3.45Å; V172-M175 PolarHBondContact O-N 2.88Å; V172-K176 PolarHBondContact O-N 2.97Å; V172-L266 HydrophobicContact CG2-CD1 4.3Å; V172-E269 HydrophobicContact CG2-CB 3.96Å; V172-V273 HydrophobicContact CB-CG2 4.25Å; V172-V273 HydrophobicContact CG1-CB 3.73Å; V172-V273 HydrophobicContact CG1-CG1 3.93Å; V172-V273 HydrophobicContact CG1-CG2 3.57Å
173	N	74	Confident	72.6	Confident	75 Å²	75	79.2 Å²	79.2	40%	0.401	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-30.2	172.8	-74.4	-31.1	0	0	0	112.2	P170 M175 K176	P170-N173 PolarHBondContact O-N 3.37Å; N173-M175 VanDerWaalsContact C-N 3.27Å; N173-M175 PolarHBondContact O-N 3.37Å; N173-K176 PolarHBondContact O-N 3.21Å
174	V	76.5	Confident	72.5	Confident	126 Å²	126	80 Å²	80	76%	0.764	43%	0.431	S	S	*	.	H	α-helix	trans	-65.7	-31.5	171.6	-178.6	0	0	0	0	111.8	P170 M171 V172 K176	P170-V174 WeakPolarHBondContact O-CG2 3.27Å; P170-V174 PolarHBondContact O-N 2.97Å; M171-V174 WeakPolarHBondContact O-CB 3.09Å; M171-V174 PolarHBondContact O-N 3.3Å; V172-V174 PolarHBondContact O-N 3.33Å; V174-K176 VanDerWaalsContact C-N 3.3Å
175	M	75.6	Confident	72.6	Confident	13 Å²	13	77.1 Å²	77.1	6%	0.064	42%	0.415	C	S	.	.	H	α-helix	trans	-76.2	-19.8	178.3	-59.8	175.2	178.6	0	0	112.7	V172 N173 L177 R249 V250 L266 L270	V172-M175 WeakPolarHBondContact O-CB 3.45Å; V172-M175 PolarHBondContact O-N 2.88Å; N173-M175 VanDerWaalsContact C-N 3.27Å; N173-M175 PolarHBondContact O-N 3.37Å; M175-L177 PolarHBondContact O-N 3.23Å; M175-R249 PolarHBondContact O-N 3.24Å; M175-V250 HydrophobicContact CB-CG2 4.16Å; M175-V250 HydrophobicContact CE-CG1 4.39Å; M175-V250 HydrophobicContact CG-CG2 4.04Å; M175-V250 HydrophobicContact SD-CG1 4.47Å; M175-V250 HydrophobicContact SD-CG2 3.57Å; M175-V250 VanDerWaalsContact SD-CG2 3.57Å; M175-L266 HydrophobicContact CE-CD1 3.84Å; M175-L266 HydrophobicContact CE-CD2 3.9Å; M175-L266 HydrophobicContact CE-CG 4.08Å; M175-L270 HydrophobicContact SD-CD1 3.89Å
176	K	74.2	Confident	73.2	Confident	66 Å²	66	76.3 Å²	76.3	29%	0.287	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-77.7	113.4	176.5	-170.9	176.3	175.5	-178.2	0	110	V172 N173 V174 E178 L248 H277	V172-K176 PolarHBondContact O-N 2.97Å; N173-K176 PolarHBondContact O-N 3.21Å; V174-K176 VanDerWaalsContact C-N 3.3Å; K176-E178 PolarHBondContact O-N 3.06Å; K176-L248 HydrophobicContact CB-CD2 3.97Å; K176-L248 HydrophobicContact CG-CD2 4.24Å; K176-H277 PolarHBondContact NZ-CD2 3.25Å; K176-H277 PolarHBondContact NZ-NE2 3.49Å
177	L	69.5	Low	74	Confident	76 Å²	76	73.3 Å²	73.3	40%	0.398	40%	0.398	S	S	.	.			trans	-78.1	104.8	171.2	-86.8	153.3	0	0	0	108.8	M175 K179 F247 R249	M175-L177 PolarHBondContact O-N 3.23Å; L177-K179 PolarHBondContact O-N 3.47Å; L177-F247 HydrophobicContact CB-CD1 4.26Å; L177-F247 HydrophobicContact CD1-CD1 3.46Å; L177-F247 VanDerWaalsContact CD1-CD1 3.46Å; L177-F247 HydrophobicContact CD1-CE1 3.57Å; L177-F247 HydrophobicContact CG-CD1 4.48Å; L177-F247 PolarHBondContact N-O 3.29Å; L177-R249 HydrophobicContact CD1-CB 3.49Å; L177-R249 VanDerWaalsContact CD1-CB 3.49Å; L177-R249 HydrophobicContact CD1-CG 4.38Å
178	E	61.5	Low	74.8	Confident	181 Å²	181	71.8 Å²	71.8	85%	0.846	39%	0.39	S	S	*	.	S	Bend	trans	-66.9	-21.8	174.5	-67.7	-167.5	152	0	0	113.1	K176	K176-E178 PolarHBondContact O-N 3.06Å
179	K	64.6	Low	75.5	Confident	168 Å²	168	70.4 Å²	70.4	73%	0.73	38%	0.384	S	S	*	.	S	Bend	trans	-116.3	127.4	-177.7	-65.3	-178.2	-177.4	175.7	0	110.1	L177	L177-K179 PolarHBondContact O-N 3.47Å
180	A	65	Low	76.2	Confident	63 Å²	63	68.2 Å²	68.2	52%	0.521	37%	0.373	S	S	.	.			trans	-55.6	132.6	168	0	0	0	0	0	109.3
181	P	71.2	Confident	76.5	Confident	20 Å²	20	65.2 Å²	65.2	13%	0.13	35%	0.352	C	S	.	.			trans	-54.3	150.1	170.7	18.7	-29.1	0	0	0	111.2	E183 K237 A240 N241	P181-E183 VanDerWaalsContact C-N 3.3Å; P181-E183 WeakPolarHBondContact CB-OE2 3.47Å; P181-K237 HydrophobicContact CB-CB 3.81Å; P181-K237 HydrophobicContact CB-CD 4.33Å; P181-K237 HydrophobicContact CB-CG 4.1Å; P181-K237 HydrophobicContact CG-CB 3.86Å; P181-K237 HydrophobicContact CG-CG 4.28Å; P181-K237 WeakPolarHBondContact CG-O 3.34Å; P181-A240 HydrophobicContact CG-CB 3.8Å; P181-N241 HydrophobicContact CG-CB 4.39Å; P181-N241 WeakPolarHBondContact O-CB 3.14Å; P181-N241 PolarHBondContact O-ND2 3.09Å; P181-N241 PolarHBondContact O-OD1 2.71Å
182	Q	77.4	Confident	77.1	Confident	177 Å²	177	66.1 Å²	66.1	83%	0.827	36%	0.358	S	S	*	.	S	Bend	trans	-79.1	-17.6	-177.2	-66.5	-177.6	-0.7	0	0	112.6
183	E	81.4	Confident	77.8	Confident	51 Å²	51	69.4 Å²	69.4	24%	0.238	38%	0.381	C	S	.	.			trans	-69.2	132.8	-176.3	-58	95.2	145.9	0	0	111	P181 K237 A238 N241	P181-E183 VanDerWaalsContact C-N 3.3Å; P181-E183 WeakPolarHBondContact CB-OE2 3.47Å; E183-K237 VanDerWaalsContact OE1-CD 3.24Å; E183-K237 WeakPolarHBondContact OE1-CD 3.36Å; E183-K237 IonicContact OE1-NZ 3.21Å; E183-K237 PolarHBondContact OE1-NZ 3.37Å; E183-A238 WeakPolarHBondContact O-CA 3.23Å; E183-N241 VanDerWaalsContact O-CB 3.27Å; E183-N241 WeakPolarHBondContact O-CB 3.31Å; E183-N241 PolarHBondContact O-ND2 2.92Å
184	T	85	Confident	78.5	Confident	47 Å²	47	67 Å²	67	29%	0.288	37%	0.367	S	S	.	.			trans	-112.8	166	175.3	62	0	0	0	0	110.6	A186 D187 N241	T184-A186 PolarHBondContact O-N 2.79Å; T184-A186 VanDerWaalsContact O-N 3.11Å; T184-A186 PolarHBondContact OG1-N 3.35Å; T184-D187 PolarHBondContact N-OD2 2.67Å; T184-D187 WeakPolarHBondContact O-CB 3.44Å; T184-D187 PolarHBondContact O-N 3.5Å; T184-D187 PolarHBondContact OG1-OD2 3.41Å; T184-N241 WeakPolarHBondContact CG2-ND2 3.42Å
185	Y	85.6	Confident	79.1	Confident	17 Å²	17	61.6 Å²	61.6	7%	0.067	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-59.2	-22.8	173	-64.8	-54	0	0	0	112.8	D187 V188 I195 I198 K199 L235 A238 V239 Q242	Y185-D187 PolarHBondContact O-N 3.47Å; Y185-V188 PolarHBondContact O-N 3.23Å; Y185-I195 HydrophobicContact CD1-CG2 4.01Å; Y185-I195 HydrophobicContact CE1-CG2 4.37Å; Y185-I195 HydrophobicContact CG-CG2 4.24Å; Y185-I198 HydrophobicContact CE1-CG2 4.15Å; Y185-K199 HydrophobicContact CE2-CG 4.16Å; Y185-L235 HydrophobicContact CD1-CD1 4.12Å; Y185-L235 HydrophobicContact CE1-CD1 4.1Å; Y185-A238 HydrophobicContact CD1-CB 3.75Å; Y185-A238 HydrophobicContact CE1-CB 4.01Å; Y185-A238 HydrophobicContact CG-CB 4.47Å; Y185-V239 HydrophobicContact CE1-CG2 3.98Å; Y185-V239 WeakPolarHBondContact OH-CA 3.27Å; Y185-V239 VanDerWaalsContact OH-CG2 3.29Å; Y185-V239 WeakPolarHBondContact OH-CG2 3.34Å; Y185-Q242 HydrophobicContact CD2-CG 3.78Å; Y185-Q242 HydrophobicContact CE2-CB 4.08Å; Y185-Q242 HydrophobicContact CE2-CG 3.55Å
186	A	84.6	Confident	79.7	Confident	80 Å²	80	68 Å²	68	66%	0.661	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-70.6	-21.4	175.9	0	0	0	0	0	113	T184 V188	T184-A186 PolarHBondContact O-N 2.79Å; T184-A186 VanDerWaalsContact O-N 3.11Å; T184-A186 PolarHBondContact OG1-N 3.35Å; A186-V188 VanDerWaalsContact C-N 3.31Å
187	D	83	Confident	80.3	Confident	57 Å²	57	68.8 Å²	68.8	31%	0.305	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-83.7	-9	175.2	-57.4	-57	0	0	0	112.2	T184 Y185	T184-D187 PolarHBondContact N-OD2 2.67Å; T184-D187 WeakPolarHBondContact O-CB 3.44Å; T184-D187 PolarHBondContact O-N 3.5Å; T184-D187 PolarHBondContact OG1-OD2 3.41Å; Y185-D187 PolarHBondContact O-N 3.47Å
188	V	84.2	Confident	81.1	Confident	21 Å²	21	65.2 Å²	65.2	13%	0.127	35%	0.35	C	S	.	.	S	Bend	trans	-87.1	112.5	174.9	-173.4	0	0	0	0	108.6	Y185 A186 G190 I195 L234 L235 A238	Y185-V188 PolarHBondContact O-N 3.23Å; A186-V188 VanDerWaalsContact C-N 3.31Å; V188-G190 PolarHBondContact O-N 3.05Å; V188-I195 HydrophobicContact CB-CD1 4.17Å; V188-I195 HydrophobicContact CG1-CD1 4.04Å; V188-L234 HydrophobicContact CB-CD2 4.33Å; V188-L234 HydrophobicContact CG2-CD2 3.37Å; V188-L235 HydrophobicContact CG2-CD1 4.26Å; V188-A238 HydrophobicContact CG2-CB 4.36Å
189	G	82.1	Confident	82.2	Confident	10 Å²	10	61 Å²	61	10%	0.103	33%	0.329	C	S	.	.			trans	-76.3	112.7	175	0	0	0	0	0	111.7	T360	G189-T360 WeakPolarHBondContact O-CG2 3.02Å
190	G	82.5	Confident	82.8	Confident	4 Å²	4	54 Å²	54	4%	0.041	30%	0.302	C	S	.	.	S	Bend	trans	73.3	-151.4	178.1	0	0	0	0	0	113.3	V188 D192 I195	V188-G190 PolarHBondContact O-N 3.05Å; G190-D192 VanDerWaalsContact C-N 3.3Å; G190-D192 PolarHBondContact O-N 3.47Å; G190-I195 WeakPolarHBondContact O-CD1 3.17Å
191	L	82.7	Confident	83.4	Confident	30 Å²	30	51.3 Å²	51.3	16%	0.157	28%	0.278	C	S	.	.			trans	59.2	35.9	-177.3	-59.3	170.4	0	0	0	113.8	S193 Q194 I195 F353	L191-S193 PolarHBondContact O-N 2.76Å; L191-Q194 HydrophobicContact CB-CB 4.29Å; L191-Q194 HydrophobicContact CD2-CG 4.46Å; L191-Q194 PolarHBondContact O-N 3.28Å; L191-Q194 VanDerWaalsContact O-N 3.12Å; L191-Q194 PolarHBondContact O-OE1 2.94Å; L191-I195 VanDerWaalsContact O-CG1 3.31Å; L191-I195 WeakPolarHBondContact O-CG1 3.36Å; L191-I195 PolarHBondContact O-N 3.43Å; L191-F353 HydrophobicContact CD1-CD1 3.84Å; L191-F353 HydrophobicContact CD1-CE1 4.03Å
192	D	85.8	Confident	83.9	Confident	107 Å²	107	52 Å²	52	57%	0.572	28%	0.28	S	S	*	.	H	α-helix	trans	-57.7	-35.8	-175.1	-64.4	-59.5	0	0	0	112.4	G190 Q196 K363	G190-D192 VanDerWaalsContact C-N 3.3Å; G190-D192 PolarHBondContact O-N 3.47Å; D192-Q196 WeakPolarHBondContact O-CB 3.39Å; D192-Q196 PolarHBondContact O-N 2.93Å; D192-K363 IonicContact OD2-NZ 2.89Å
193	S	87.9	Confident	84.1	Confident	68 Å²	68	46.8 Å²	46.8	48%	0.476	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-45.3	176.2	54.3	0	0	0	0	112.2	L191 Q196 E197	L191-S193 PolarHBondContact O-N 2.76Å; S193-Q196 PolarHBondContact O-N 3.11Å; S193-E197 PolarHBondContact O-N 3.12Å
194	Q	89.1	Confident	84.1	Confident	24 Å²	24	45 Å²	45	11%	0.112	25%	0.25	C	S	.	.	H	α-helix	trans	-66.8	-37.6	177.5	-64.8	80.2	5.5	0	0	111.7	L191 Q196 E197 I198 I351 E352	L191-Q194 HydrophobicContact CB-CB 4.29Å; L191-Q194 HydrophobicContact CD2-CG 4.46Å; L191-Q194 PolarHBondContact O-N 3.28Å; L191-Q194 VanDerWaalsContact O-N 3.12Å; L191-Q194 PolarHBondContact O-OE1 2.94Å; Q194-Q196 VanDerWaalsContact C-N 3.33Å; Q194-E197 PolarHBondContact O-N 3.36Å; Q194-I198 PolarHBondContact O-N 3.14Å; Q194-I351 HydrophobicContact CB-CG2 3.67Å; Q194-I351 HydrophobicContact CG-CG2 3.49Å; Q194-I351 VanDerWaalsContact CG-CG2 3.49Å; Q194-E352 WeakPolarHBondContact CG-O 3.28Å; Q194-E352 PolarHBondContact NE2-O 3.31Å
195	I	87.8	Confident	83.8	Confident	13 Å²	13	45.1 Å²	45.1	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-42.8	173.4	-67.1	166.4	0	0	0	109.9	Y185 V188 G190 L191 E197 I198 K199 L235	Y185-I195 HydrophobicContact CD1-CG2 4.01Å; Y185-I195 HydrophobicContact CE1-CG2 4.37Å; Y185-I195 HydrophobicContact CG-CG2 4.24Å; V188-I195 HydrophobicContact CB-CD1 4.17Å; V188-I195 HydrophobicContact CG1-CD1 4.04Å; G190-I195 WeakPolarHBondContact O-CD1 3.17Å; L191-I195 VanDerWaalsContact O-CG1 3.31Å; L191-I195 WeakPolarHBondContact O-CG1 3.36Å; L191-I195 PolarHBondContact O-N 3.43Å; I195-E197 VanDerWaalsContact C-N 3.33Å; I195-E197 PolarHBondContact O-N 3.11Å; I195-I198 WeakPolarHBondContact O-CG2 3.36Å; I195-I198 PolarHBondContact O-N 3Å; I195-K199 HydrophobicContact CG2-CD 4.11Å; I195-K199 HydrophobicContact CG2-CG 4.4Å; I195-K199 WeakPolarHBondContact O-CB 3.24Å; I195-K199 VanDerWaalsContact O-CG 3.26Å; I195-K199 WeakPolarHBondContact O-CG 3.5Å; I195-K199 PolarHBondContact O-N 3.38Å; I195-L235 HydrophobicContact CG1-CD1 3.69Å
196	Q	87.6	Confident	83.5	Confident	149 Å²	149	47.7 Å²	47.7	70%	0.696	27%	0.266	S	S	*	.	H	α-helix	trans	-64.1	-39.4	176.7	-171.2	175.9	7.1	0	0	112	D192 S193 Q194 K199 S200	D192-Q196 WeakPolarHBondContact O-CB 3.39Å; D192-Q196 PolarHBondContact O-N 2.93Å; S193-Q196 PolarHBondContact O-N 3.11Å; Q194-Q196 VanDerWaalsContact C-N 3.33Å; Q196-K199 PolarHBondContact O-N 3.47Å; Q196-S200 PolarHBondContact O-N 2.86Å
197	E	87.2	Confident	83.4	Confident	82 Å²	82	47.8 Å²	47.8	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-42.3	174.9	-74.1	-167.1	-159.2	0	0	112.3	S193 Q194 I195 S200 I351	S193-E197 PolarHBondContact O-N 3.12Å; Q194-E197 PolarHBondContact O-N 3.36Å; I195-E197 VanDerWaalsContact C-N 3.33Å; I195-E197 PolarHBondContact O-N 3.11Å; E197-S200 VanDerWaalsContact O-CB 3.22Å; E197-S200 WeakPolarHBondContact O-CB 3.44Å; E197-S200 PolarHBondContact O-N 2.85Å; E197-S200 VanDerWaalsContact O-N 3.16Å; E197-S200 PolarHBondContact O-OG 3Å; E197-I351 HydrophobicContact CB-CD1 3.8Å; E197-I351 HydrophobicContact CB-CG1 4.28Å
198	I	86.4	Confident	83.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-73	-29.6	179	-147.3	164.5	0	0	0	112.5	Y185 Q194 I195 S200 V201 L224 L235 V239 I351	Y185-I198 HydrophobicContact CE1-CG2 4.15Å; Q194-I198 PolarHBondContact O-N 3.14Å; I195-I198 WeakPolarHBondContact O-CG2 3.36Å; I195-I198 PolarHBondContact O-N 3Å; I198-S200 PolarHBondContact O-N 2.89Å; I198-S200 VanDerWaalsContact O-N 3.14Å; I198-V201 HydrophobicContact CG1-CG2 4.42Å; I198-V201 VanDerWaalsContact O-CB 3.22Å; I198-V201 WeakPolarHBondContact O-CB 3.42Å; I198-V201 WeakPolarHBondContact O-CG2 3.42Å; I198-V201 PolarHBondContact O-N 3.32Å; I198-L224 HydrophobicContact CD1-CD1 4.16Å; I198-L224 HydrophobicContact CD1-CD2 3.95Å; I198-L235 HydrophobicContact CB-CD2 4.1Å; I198-L235 HydrophobicContact CD1-CD2 3.61Å; I198-L235 HydrophobicContact CD1-CG 3.88Å; I198-L235 HydrophobicContact CG1-CD2 4.47Å; I198-L235 HydrophobicContact CG2-CD1 4.16Å; I198-L235 HydrophobicContact CG2-CD2 3.88Å; I198-L235 HydrophobicContact CG2-CG 4.04Å; I198-V239 HydrophobicContact CB-CG2 4.36Å; I198-V239 HydrophobicContact CD1-CG2 3.66Å; I198-V239 HydrophobicContact CG1-CG2 3.75Å; I198-V239 HydrophobicContact CG2-CG2 3.7Å; I198-I351 HydrophobicContact CB-CD1 4.19Å; I198-I351 HydrophobicContact CG1-CD1 4.46Å
199	K	84.1	Confident	83.5	Confident	92 Å²	92	52.4 Å²	52.4	40%	0.4	28%	0.277	S	S	.	.	H	α-helix	trans	-59.9	-20.5	170.2	-79.9	177.1	176.4	-178.4	0	112.7	Y185 I195 Q196 V201 E202 L203	Y185-K199 HydrophobicContact CE2-CG 4.16Å; I195-K199 HydrophobicContact CG2-CD 4.11Å; I195-K199 HydrophobicContact CG2-CG 4.4Å; I195-K199 WeakPolarHBondContact O-CB 3.24Å; I195-K199 VanDerWaalsContact O-CG 3.26Å; I195-K199 WeakPolarHBondContact O-CG 3.5Å; I195-K199 PolarHBondContact O-N 3.38Å; Q196-K199 PolarHBondContact O-N 3.47Å; K199-V201 PolarHBondContact O-N 3.01Å; K199-E202 WeakPolarHBondContact O-CB 3.5Å; K199-E202 PolarHBondContact O-N 3.03Å; K199-E202 VanDerWaalsContact O-N 3.13Å; K199-L203 PolarHBondContact O-N 3.38Å
200	S	79.2	Confident	83.9	Confident	23 Å²	23	56 Å²	56	16%	0.161	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-15.2	170	80	0	0	0	0	113.7	Q196 E197 I198 P204	Q196-S200 PolarHBondContact O-N 2.86Å; E197-S200 VanDerWaalsContact O-CB 3.22Å; E197-S200 WeakPolarHBondContact O-CB 3.44Å; E197-S200 PolarHBondContact O-N 2.85Å; E197-S200 VanDerWaalsContact O-N 3.16Å; E197-S200 PolarHBondContact O-OG 3Å; I198-S200 PolarHBondContact O-N 2.89Å; I198-S200 VanDerWaalsContact O-N 3.14Å; S200-P204 WeakPolarHBondContact O-CD 3.33Å; S200-P204 WeakPolarHBondContact O-CG 3.35Å
201	V	77.5	Confident	84	Confident	6 Å²	6	57.3 Å²	57.3	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-81.6	-31.9	171.7	-175.3	0	0	0	0	111.5	I198 K199 P204 V222 K326	I198-V201 HydrophobicContact CG1-CG2 4.42Å; I198-V201 VanDerWaalsContact O-CB 3.22Å; I198-V201 WeakPolarHBondContact O-CB 3.42Å; I198-V201 WeakPolarHBondContact O-CG2 3.42Å; I198-V201 PolarHBondContact O-N 3.32Å; K199-V201 PolarHBondContact O-N 3.01Å; V201-P204 WeakPolarHBondContact O-CD 3.48Å; V201-V222 HydrophobicContact CG2-CB 4.47Å; V201-V222 HydrophobicContact CG2-CG2 3.37Å; V201-K326 HydrophobicContact CG1-CB 4Å; V201-K326 HydrophobicContact CG1-CG 4.12Å
202	E	80.2	Confident	84.2	Confident	35 Å²	35	63.2 Å²	63.2	16%	0.164	32%	0.324	C	S	.	.	H	α-helix	trans	-76.8	-38.6	176.4	-178.3	-173.5	159.7	0	0	111.6	K199 L205 T206 T243	K199-E202 WeakPolarHBondContact O-CB 3.5Å; K199-E202 PolarHBondContact O-N 3.03Å; K199-E202 VanDerWaalsContact O-N 3.13Å; E202-L205 WeakPolarHBondContact O-CA 3.45Å; E202-L205 WeakPolarHBondContact O-CB 3.39Å; E202-L205 PolarHBondContact O-N 2.97Å; E202-T206 HydrophobicContact CG-CG2 4.05Å; E202-T206 PolarHBondContact O-N 2.85Å; E202-T206 VanDerWaalsContact O-N 3.09Å; E202-T206 PolarHBondContact O-OG1 3.03Å; E202-T243 HydrophobicContact CB-CG2 4.27Å; E202-T243 HydrophobicContact CG-CG2 4.05Å
203	L	82.5	Confident	84.4	Confident	66 Å²	66	66.1 Å²	66.1	35%	0.346	33%	0.334	S	S	.	.	H	α-helix	trans	-55.3	-40.6	-176	-168.7	70	0	0	0	114.4	K199 L205 T206 H207 L210 Y211	K199-L203 PolarHBondContact O-N 3.38Å; L203-L205 PolarHBondContact O-N 3.45Å; L203-T206 WeakPolarHBondContact CA-OG1 3.44Å; L203-T206 PolarHBondContact O-N 3.12Å; L203-T206 PolarHBondContact O-OG1 3.31Å; L203-H207 HydrophobicContact CD1-CB 4.43Å; L203-H207 CarbonylContact O-C 3.58Å; L203-H207 PolarHBondContact O-N 2.94Å; L203-L210 HydrophobicContact CD1-CD1 4.2Å; L203-L210 HydrophobicContact CD2-CD1 4.39Å; L203-L210 HydrophobicContact CG-CD1 4.42Å; L203-Y211 HydrophobicContact CB-CE2 4.48Å; L203-Y211 HydrophobicContact CD2-CE2 4.31Å; L203-Y211 HydrophobicContact CG-CE2 4.24Å
204	P	81.8	Confident	84.5	Confident	15 Å²	15	70 Å²	70	10%	0.097	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-28.7	173	-23.5	30.9	0	0	0	114.1	S200 V201 Y211 P218	S200-P204 WeakPolarHBondContact O-CD 3.33Å; S200-P204 WeakPolarHBondContact O-CG 3.35Å; V201-P204 WeakPolarHBondContact O-CD 3.48Å; P204-Y211 HydrophobicContact CB-CD2 4.39Å; P204-Y211 HydrophobicContact CB-CE2 4.05Å; P204-Y211 HydrophobicContact CG-CD2 4.42Å; P204-Y211 HydrophobicContact CG-CE2 3.65Å; P204-P218 HydrophobicContact CB-CB 3.76Å; P204-P218 HydrophobicContact CB-CG 4.33Å; P204-P218 HydrophobicContact CG-CB 3.58Å
205	L	77.8	Confident	84.4	Confident	49 Å²	49	72.1 Å²	72.1	26%	0.257	38%	0.375	S	S	.	.	H	α-helix	trans	-83.3	-33.7	-179.6	-63.5	174.2	0	0	0	111.7	E202 L203 T243 A245 P279 I281 D324	E202-L205 WeakPolarHBondContact O-CA 3.45Å; E202-L205 WeakPolarHBondContact O-CB 3.39Å; E202-L205 PolarHBondContact O-N 2.97Å; L203-L205 PolarHBondContact O-N 3.45Å; L205-T243 HydrophobicContact CD1-CG2 4.25Å; L205-A245 HydrophobicContact CD1-CB 4.1Å; L205-P279 HydrophobicContact CD2-CB 3.65Å; L205-I281 HydrophobicContact CD1-CD1 4.37Å; L205-D324 HydrophobicContact CD2-CB 4.47Å
206	T	79.5	Confident	84.4	Confident	70 Å²	70	76.1 Å²	76.1	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-85.8	-39.4	-179.8	51.8	0	0	0	0	112.7	E202 L203	E202-T206 HydrophobicContact CG-CG2 4.05Å; E202-T206 PolarHBondContact O-N 2.85Å; E202-T206 VanDerWaalsContact O-N 3.09Å; E202-T206 PolarHBondContact O-OG1 3.03Å; L203-T206 WeakPolarHBondContact CA-OG1 3.44Å; L203-T206 PolarHBondContact O-N 3.12Å; L203-T206 PolarHBondContact O-OG1 3.31Å
207	H	82.8	Confident	84.1	Confident	83 Å²	83	78.2 Å²	78.2	38%	0.384	40%	0.402	S	S	.	.			trans	-136.2	74.1	-177	-65.1	-69	0	0	0	111.6	L203 E209 L210	L203-H207 HydrophobicContact CD1-CB 4.43Å; L203-H207 CarbonylContact O-C 3.58Å; L203-H207 PolarHBondContact O-N 2.94Å; H207-E209 HydrophobicContact CB-CG 4.45Å; H207-E209 IonicContact ND1-OE1 3.73Å; H207-E209 PolarHBondContact ND1-OE1 3.02Å; H207-E209 PolarHBondContact O-N 3.35Å; H207-L210 HydrophobicContact CB-CD1 3.75Å; H207-L210 HydrophobicContact CB-CG 4.02Å; H207-L210 PolarHBondContact O-N 2.93Å
208	P	82.3	Confident	83.9	Confident	66 Å²	66	76.2 Å²	76.2	43%	0.429	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-29.9	175.7	25.5	-34	0	0	0	112.4	L210 Y211 E212	P208-L210 VanDerWaalsContact C-N 3.27Å; P208-L210 PolarHBondContact O-N 3.34Å; P208-Y211 PolarHBondContact O-N 2.76Å; P208-E212 PolarHBondContact O-N 3.21Å; P208-E212 VanDerWaalsContact O-N 3.13Å
209	E	87.6	Confident	83.7	Confident	109 Å²	109	77.2 Å²	77.2	51%	0.509	40%	0.403	S	S	.	.	H	α-helix	trans	-53.9	-36.7	178.7	56.9	-157.4	165.7	0	0	113.6	H207 Y211 E212 E213	H207-E209 HydrophobicContact CB-CG 4.45Å; H207-E209 IonicContact ND1-OE1 3.73Å; H207-E209 PolarHBondContact ND1-OE1 3.02Å; H207-E209 PolarHBondContact O-N 3.35Å; E209-Y211 VanDerWaalsContact C-N 3.29Å; E209-Y211 PolarHBondContact O-N 3Å; E209-E212 PolarHBondContact O-N 3.33Å; E209-E213 WeakPolarHBondContact O-CG 3.26Å; E209-E213 PolarHBondContact O-N 3.5Å
210	L	89.1	Confident	83.5	Confident	84 Å²	84	77.3 Å²	77.3	44%	0.44	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-34.5	177.3	-64.8	174.8	0	0	0	112.7	L203 H207 P208 M214	L203-L210 HydrophobicContact CD1-CD1 4.2Å; L203-L210 HydrophobicContact CD2-CD1 4.39Å; L203-L210 HydrophobicContact CG-CD1 4.42Å; H207-L210 HydrophobicContact CB-CD1 3.75Å; H207-L210 HydrophobicContact CB-CG 4.02Å; H207-L210 PolarHBondContact O-N 2.93Å; P208-L210 VanDerWaalsContact C-N 3.27Å; P208-L210 PolarHBondContact O-N 3.34Å; L210-M214 PolarHBondContact O-N 2.78Å
211	Y	86	Confident	83.9	Confident	32 Å²	32	76.2 Å²	76.2	13%	0.125	40%	0.396	C	S	.	.	H	α-helix	trans	-79.5	-35.8	178.4	-71.9	-90.2	0	0	0	111.4	L203 P204 P208 E209 G215 I216 P218	L203-Y211 HydrophobicContact CB-CE2 4.48Å; L203-Y211 HydrophobicContact CD2-CE2 4.31Å; L203-Y211 HydrophobicContact CG-CE2 4.24Å; P204-Y211 HydrophobicContact CB-CD2 4.39Å; P204-Y211 HydrophobicContact CB-CE2 4.05Å; P204-Y211 HydrophobicContact CG-CD2 4.42Å; P204-Y211 HydrophobicContact CG-CE2 3.65Å; P208-Y211 PolarHBondContact O-N 2.76Å; E209-Y211 VanDerWaalsContact C-N 3.29Å; E209-Y211 PolarHBondContact O-N 3Å; Y211-G215 PolarHBondContact O-N 3.5Å; Y211-I216 HydrophobicContact CD1-CD1 3.91Å; Y211-I216 HydrophobicContact CD1-CG1 3.89Å; Y211-I216 HydrophobicContact CE1-CD1 4.14Å; Y211-I216 PolarHBondContact O-N 3.37Å; Y211-I216 VanDerWaalsContact O-N 3.13Å; Y211-P218 HydrophobicContact CD1-CB 3.9Å; Y211-P218 HydrophobicContact CE1-CB 3.89Å; Y211-P218 HydrophobicContact CG-CB 4.34Å
212	E	85.9	Confident	84.5	Confident	155 Å²	155	76.1 Å²	76.1	72%	0.724	40%	0.395	S	S	*	.	H	α-helix	trans	-66.9	-45	176.4	-68.6	-173.7	172.9	0	0	112.2	P208 E209 M214 G215	P208-E212 PolarHBondContact O-N 3.21Å; P208-E212 VanDerWaalsContact O-N 3.13Å; E209-E212 PolarHBondContact O-N 3.33Å; E212-M214 VanDerWaalsContact C-N 3.34Å; E212-M214 PolarHBondContact O-N 3.21Å; E212-G215 PolarHBondContact O-N 3.14Å; E212-G215 VanDerWaalsContact O-N 3.11Å
213	E	90	Very high	85	Confident	168 Å²	168	74.5 Å²	74.5	79%	0.785	39%	0.387	S	S	*	.	H	α-helix	trans	-62.8	-39.8	177.6	-74.9	-173.3	170.3	0	0	112.4	E209 G215	E209-E213 WeakPolarHBondContact O-CG 3.26Å; E209-E213 PolarHBondContact O-N 3.5Å; E213-G215 VanDerWaalsContact C-N 3.3Å
214	M	90.2	Very high	85.5	Confident	149 Å²	149	71.3 Å²	71.3	73%	0.734	37%	0.371	S	S	*	.	H	α-helix	trans	-77.7	-15	175.9	-77.1	-66.9	-169.2	0	0	113.3	L210 E212 I216	L210-M214 PolarHBondContact O-N 2.78Å; E212-M214 VanDerWaalsContact C-N 3.34Å; E212-M214 PolarHBondContact O-N 3.21Å; M214-I216 HydrophobicContact CB-CD1 4.4Å; M214-I216 HydrophobicContact CB-CG1 3.84Å; M214-I216 PolarHBondContact O-N 3.32Å
215	G	87.1	Confident	86.1	Confident	68 Å²	68	72.9 Å²	72.9	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	22.1	-176.9	0	0	0	0	0	114.2	Y211 E212 E213	Y211-G215 PolarHBondContact O-N 3.5Å; E212-G215 PolarHBondContact O-N 3.14Å; E212-G215 VanDerWaalsContact O-N 3.11Å; E213-G215 VanDerWaalsContact C-N 3.3Å
216	I	86.9	Confident	86.7	Confident	98 Å²	98	71.3 Å²	71.3	50%	0.503	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-101.9	141.4	180	56.3	163.3	0	0	0	110.7	Y211 M214	Y211-I216 HydrophobicContact CD1-CD1 3.91Å; Y211-I216 HydrophobicContact CD1-CG1 3.89Å; Y211-I216 HydrophobicContact CE1-CD1 4.14Å; Y211-I216 PolarHBondContact O-N 3.37Å; Y211-I216 VanDerWaalsContact O-N 3.13Å; M214-I216 HydrophobicContact CB-CD1 4.4Å; M214-I216 HydrophobicContact CB-CG1 3.84Å; M214-I216 PolarHBondContact O-N 3.32Å
217	K	81.8	Confident	87.1	Confident	192 Å²	192	69.7 Å²	69.7	84%	0.835	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-77.3	134.4	173.2	-68	-176.6	179.7	179.4	0	109.4
218	P	82.9	Confident	87.3	Confident	40 Å²	40	69.9 Å²	69.9	26%	0.26	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-63.8	151.6	175	28.1	-35.2	0	0	0	110.4	P204 Y211 K220	P204-P218 HydrophobicContact CB-CB 3.76Å; P204-P218 HydrophobicContact CB-CG 4.33Å; P204-P218 HydrophobicContact CG-CB 3.58Å; Y211-P218 HydrophobicContact CD1-CB 3.9Å; Y211-P218 HydrophobicContact CE1-CB 3.89Å; Y211-P218 HydrophobicContact CG-CB 4.34Å; P218-K220 PolarHBondContact O-N 2.91Å
219	P	82.6	Confident	87.4	Confident	22 Å²	22	68.2 Å²	68.2	14%	0.143	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-58.3	140.9	175.8	26.1	-33.6	0	0	0	110.2	K326 D348 R349	P219-K326 PolarHBondContact O-NZ 3.04Å; P219-D348 WeakPolarHBondContact CA-OD2 3.43Å; P219-D348 HydrophobicContact CB-CB 3.85Å; P219-R349 HydrophobicContact CB-CG 4.44Å
220	K	80.6	Confident	87.3	Confident	94 Å²	94	63.8 Å²	63.8	41%	0.409	35%	0.348	S	S	.	.			trans	-90.3	-44.3	-177.1	-67.8	-175.7	177.2	-176.4	0	112.2	P218 V327 D348	P218-K220 PolarHBondContact O-N 2.91Å; K220-V327 PolarHBondContact O-N 2.88Å; K220-D348 PolarHBondContact N-OD2 2.93Å
221	G	86.7	Confident	87.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	140.8	-171.3	0	0	0	0	0	113.2	V327 D348 R349	G221-V327 WeakPolarHBondContact CA-O 3.43Å; G221-D348 PolarHBondContact O-N 3.2Å; G221-R349 PolarHBondContact O-N 2.96Å
222	V	89.8	Confident	87.3	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.2	174.9	-176.1	0	0	0	0	109.4	V201 L224 V327 I328 M329 R349 I351	V201-V222 HydrophobicContact CG2-CB 4.47Å; V201-V222 HydrophobicContact CG2-CG2 3.37Å; V222-L224 HydrophobicContact CG1-CD2 3.92Å; V222-V327 PolarHBondContact N-O 2.88Å; V222-I328 WeakPolarHBondContact O-CA 3.27Å; V222-M329 PolarHBondContact O-N 2.86Å; V222-R349 WeakPolarHBondContact CA-O 3.37Å; V222-R349 HydrophobicContact CB-CB 4.44Å; V222-R349 HydrophobicContact CG1-CB 4.12Å; V222-R349 HydrophobicContact CG2-CB 4.03Å; V222-R349 HydrophobicContact CG2-CG 4.47Å; V222-I351 HydrophobicContact CG1-CD1 3.57Å; V222-I351 HydrophobicContact CG1-CG1 3.87Å
223	I	91.8	Very high	87.3	Confident	1 Å²	1	55 Å²	55	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.2	170.6	-166.2	169	0	0	0	110.5	M329 T331 L337 I342 I347 R349 K350 I351	I223-M329 CarbonylContact C-O 3.58Å; I223-M329 WeakPolarHBondContact CA-O 3.38Å; I223-M329 HydrophobicContact CG1-CB 4.2Å; I223-T331 HydrophobicContact CD1-CG2 4.02Å; I223-T331 HydrophobicContact CG1-CG2 4.19Å; I223-L337 HydrophobicContact CD1-CD1 3.74Å; I223-I342 HydrophobicContact CD1-CG2 4.39Å; I223-I347 HydrophobicContact CB-CD1 4.21Å; I223-I347 HydrophobicContact CB-CG2 3.91Å; I223-I347 HydrophobicContact CD1-CD1 4.23Å; I223-I347 HydrophobicContact CG2-CG2 3.67Å; I223-R349 PolarHBondContact N-O 3.31Å; I223-K350 HydrophobicContact CG2-CB 3.85Å; I223-K350 HydrophobicContact CG2-CG 3.67Å; I223-I351 PolarHBondContact O-N 3.1Å
224	L	93.2	Very high	87.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.7	175.8	-50	-177.1	0	0	0	107.9	I198 V222 K232 A236 I328 M329 A330 T331 I351 F353	I198-L224 HydrophobicContact CD1-CD1 4.16Å; I198-L224 HydrophobicContact CD1-CD2 3.95Å; V222-L224 HydrophobicContact CG1-CD2 3.92Å; L224-K232 HydrophobicContact CB-CB 4.22Å; L224-K232 HydrophobicContact CB-CD 4.44Å; L224-K232 HydrophobicContact CB-CG 4.3Å; L224-K232 HydrophobicContact CD1-CB 4.48Å; L224-A236 HydrophobicContact CD1-CB 4.48Å; L224-I328 HydrophobicContact CD1-CG2 3.91Å; L224-I328 HydrophobicContact CG-CG2 4.11Å; L224-M329 PolarHBondContact N-O 3.09Å; L224-A330 HydrophobicContact CB-CB 4.49Å; L224-A330 WeakPolarHBondContact O-CA 3.41Å; L224-T331 PolarHBondContact O-N 2.98Å; L224-I351 HydrophobicContact CD2-CB 3.9Å; L224-I351 HydrophobicContact CD2-CD1 3.85Å; L224-I351 HydrophobicContact CD2-CG1 4.2Å; L224-I351 HydrophobicContact CD2-CG2 4.46Å; L224-F353 HydrophobicContact CB-CD2 4.35Å; L224-F353 HydrophobicContact CB-CE2 3.65Å; L224-F353 HydrophobicContact CB-CZ 4.37Å; L224-F353 HydrophobicContact CD1-CE2 4.44Å; L224-F353 HydrophobicContact CD1-CZ 4.37Å; L224-F353 HydrophobicContact CD2-CE2 3.79Å; L224-F353 HydrophobicContact CD2-CZ 4.15Å; L224-F353 HydrophobicContact CG-CE2 4.13Å
225	Y	93.1	Very high	87.1	Confident	47 Å²	47	42.8 Å²	42.8	18%	0.184	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	157.7	-178.4	71.9	-81.2	0	0	0	112.6	K232 T331 I334 K350 I351 E352 F353	Y225-K232 VanDerWaalsContact C-CE 3.44Å; Y225-T331 WeakPolarHBondContact CA-O 3.39Å; Y225-I334 HydrophobicContact CD1-CD1 3.65Å; Y225-I334 HydrophobicContact CD2-CB 4.03Å; Y225-I334 HydrophobicContact CD2-CD1 3.99Å; Y225-I334 HydrophobicContact CD2-CG2 3.65Å; Y225-I334 HydrophobicContact CE1-CD1 3.99Å; Y225-I334 HydrophobicContact CE2-CD1 4.27Å; Y225-I334 HydrophobicContact CE2-CG2 4.11Å; Y225-I334 HydrophobicContact CG-CB 4.07Å; Y225-I334 HydrophobicContact CG-CD1 3.64Å; Y225-I334 HydrophobicContact CG-CG1 4.43Å; Y225-I334 HydrophobicContact CG-CG2 4.21Å; Y225-K350 HydrophobicContact CE1-CB 3.9Å; Y225-I351 WeakPolarHBondContact CD1-O 3.49Å; Y225-I351 PolarHBondContact N-O 2.99Å; Y225-E352 HydrophobicContact CD2-CG 4.33Å; Y225-E352 HydrophobicContact CE1-CB 4.02Å; Y225-E352 HydrophobicContact CE2-CB 3.91Å; Y225-E352 HydrophobicContact CE2-CG 3.68Å; Y225-E352 CarbonylContact O-C 3.58Å; Y225-F353 WeakPolarHBondContact O-CD2 3.29Å; Y225-F353 PolarHBondContact O-N 3.36Å
226	G	90.6	Very high	87.1	Confident	16 Å²	16	39.5 Å²	39.5	17%	0.165	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-168.3	-175.9	0	0	0	0	0	113.3	K232 N332	G226-K232 VanDerWaalsContact C-NZ 3.26Å; G226-K232 VanDerWaalsContact N-NZ 3.18Å; G226-K232 PolarHBondContact O-NZ 2.98Å; G226-N332 VanDerWaalsContact O-O 3.06Å
227	A	87.8	Confident	86.9	Confident	36 Å²	36	38 Å²	38	30%	0.298	22%	0.217	S	C	.	.	S	Bend	trans	-65.5	155.9	175.8	0	0	0	0	0	112.2	T230 K232 L355	A227-T230 HydrophobicContact CB-CG2 3.96Å; A227-T230 PolarHBondContact O-OG1 3.43Å; A227-K232 PolarHBondContact O-NZ 3.4Å; A227-L355 HydrophobicContact CB-CD2 4.03Å
228	P	86.9	Confident	87.1	Confident	87 Å²	87	28.9 Å²	28.9	57%	0.565	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	146.5	170	28.2	-34.5	0	0	0	110.5	T230	P228-T230 PolarHBondContact O-N 2.9Å
229	G	84.7	Confident	87.3	Confident	32 Å²	32	27 Å²	27	33%	0.33	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	7.8	177.1	0	0	0	0	0	116.1	G231 G392 A393	G229-G231 VanDerWaalsContact C-N 3.33Å; G229-G392 PolarHBondContact O-N 3.18Å; G229-A393 PolarHBondContact O-N 2.88Å; G229-A393 VanDerWaalsContact O-N 3.1Å
230	T	86.1	Confident	87.2	Confident	15 Å²	15	26.2 Å²	26.2	9%	0.092	16%	0.16	C	C	.	.	S	Bend	trans	-84.5	-0.2	176	56	0	0	0	0	114.5	A227 P228 F353	A227-T230 HydrophobicContact CB-CG2 3.96Å; A227-T230 PolarHBondContact O-OG1 3.43Å; P228-T230 PolarHBondContact O-N 2.9Å; T230-F353 WeakPolarHBondContact OG1-CB 3.32Å
231	G	85.8	Confident	87.4	Confident	30 Å²	30	24.3 Å²	24.3	31%	0.309	15%	0.154	S	C	.	.	S	Bend	trans	94.1	17.4	172.8	0	0	0	0	0	116.3	G229 T233 L234 L235	G229-G231 VanDerWaalsContact C-N 3.33Å; G231-T233 PolarHBondContact O-N 3.15Å; G231-L234 WeakPolarHBondContact O-CA 3.42Å; G231-L234 WeakPolarHBondContact O-CB 3.44Å; G231-L234 PolarHBondContact O-N 2.9Å; G231-L235 PolarHBondContact O-N 2.88Å
232	K	88.5	Confident	87.2	Confident	9 Å²	9	28.4 Å²	28.4	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-53.5	-49.8	177.1	-57.6	174.8	-156.1	158.1	0	113.2	L224 Y225 G226 A227 L234 L235 A236 A330 T331 N332 F353	L224-K232 HydrophobicContact CB-CB 4.22Å; L224-K232 HydrophobicContact CB-CD 4.44Å; L224-K232 HydrophobicContact CB-CG 4.3Å; L224-K232 HydrophobicContact CD1-CB 4.48Å; Y225-K232 VanDerWaalsContact C-CE 3.44Å; G226-K232 VanDerWaalsContact C-NZ 3.26Å; G226-K232 VanDerWaalsContact N-NZ 3.18Å; G226-K232 PolarHBondContact O-NZ 2.98Å; A227-K232 PolarHBondContact O-NZ 3.4Å; K232-L234 VanDerWaalsContact C-N 3.28Å; K232-L234 PolarHBondContact O-N 3.39Å; K232-L235 PolarHBondContact O-N 3.3Å; K232-A236 PolarHBondContact O-N 3.12Å; K232-A236 VanDerWaalsContact O-N 3.1Å; K232-A330 HydrophobicContact CB-CB 4.41Å; K232-T331 PolarHBondContact NZ-O 3.48Å; K232-N332 PolarHBondContact NZ-OD1 2.76Å; K232-F353 HydrophobicContact CG-CB 4.39Å; K232-F353 HydrophobicContact CG-CD1 4.18Å; K232-F353 HydrophobicContact CG-CD2 3.81Å; K232-F353 HydrophobicContact CG-CE1 4.41Å; K232-F353 HydrophobicContact CG-CE2 4.09Å; K232-F353 HydrophobicContact CG-CG 3.86Å; K232-F353 HydrophobicContact CG-CZ 4.36Å
233	T	86.2	Confident	86.7	Confident	48 Å²	48	28.8 Å²	28.8	29%	0.294	18%	0.176	S	C	.	.	H	α-helix	trans	-66.1	-32.6	177.2	-45.4	0	0	0	0	111.6	G231 K237 F283 D285	G231-T233 PolarHBondContact O-N 3.15Å; T233-K237 WeakPolarHBondContact O-CG 3.12Å; T233-K237 PolarHBondContact O-N 3.38Å; T233-K237 VanDerWaalsContact O-N 3.12Å; T233-F283 HydrophobicContact CG2-CE1 4.26Å; T233-F283 HydrophobicContact CG2-CZ 4.46Å; T233-D285 VanDerWaalsContact CG2-OD2 3.26Å; T233-D285 WeakPolarHBondContact CG2-OD2 3.48Å; T233-D285 PolarHBondContact OG1-OD1 3.02Å; T233-D285 PolarHBondContact OG1-OD2 3.47Å
234	L	88.2	Confident	86	Confident	59 Å²	59	35.3 Å²	35.3	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-69.1	-42.6	177.5	-166.4	155	0	0	0	110.7	V188 G231 K232 K237 A238	V188-L234 HydrophobicContact CB-CD2 4.33Å; V188-L234 HydrophobicContact CG2-CD2 3.37Å; G231-L234 WeakPolarHBondContact O-CA 3.42Å; G231-L234 WeakPolarHBondContact O-CB 3.44Å; G231-L234 PolarHBondContact O-N 2.9Å; K232-L234 VanDerWaalsContact C-N 3.28Å; K232-L234 PolarHBondContact O-N 3.39Å; L234-K237 PolarHBondContact O-N 2.9Å; L234-A238 PolarHBondContact O-N 3.34Å
235	L	88.8	Confident	85.3	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-43.2	176.3	-169	70.4	0	0	0	111.5	Y185 V188 I195 I198 G231 K232 K237 A238 V239 F353	Y185-L235 HydrophobicContact CD1-CD1 4.12Å; Y185-L235 HydrophobicContact CE1-CD1 4.1Å; V188-L235 HydrophobicContact CG2-CD1 4.26Å; I195-L235 HydrophobicContact CG1-CD1 3.69Å; I198-L235 HydrophobicContact CB-CD2 4.1Å; I198-L235 HydrophobicContact CD1-CD2 3.61Å; I198-L235 HydrophobicContact CD1-CG 3.88Å; I198-L235 HydrophobicContact CG1-CD2 4.47Å; I198-L235 HydrophobicContact CG2-CD1 4.16Å; I198-L235 HydrophobicContact CG2-CD2 3.88Å; I198-L235 HydrophobicContact CG2-CG 4.04Å; G231-L235 PolarHBondContact O-N 2.88Å; K232-L235 PolarHBondContact O-N 3.3Å; L235-K237 VanDerWaalsContact C-N 3.3Å; L235-K237 PolarHBondContact O-N 3.35Å; L235-A238 PolarHBondContact O-N 3.23Å; L235-A238 VanDerWaalsContact O-N 3.15Å; L235-V239 WeakPolarHBondContact O-CG2 3.5Å; L235-V239 PolarHBondContact O-N 3.43Å; L235-F353 HydrophobicContact CB-CE1 4.41Å; L235-F353 HydrophobicContact CB-CZ 4.37Å; L235-F353 HydrophobicContact CD2-CE1 4.01Å; L235-F353 HydrophobicContact CD2-CZ 3.54Å
236	A	85.7	Confident	84.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-39.3	176.7	0	0	0	0	0	112.6	L224 K232 A240 F283	L224-A236 HydrophobicContact CD1-CB 4.48Å; K232-A236 PolarHBondContact O-N 3.12Å; K232-A236 VanDerWaalsContact O-N 3.1Å; A236-A240 PolarHBondContact O-N 2.99Å; A236-A240 VanDerWaalsContact O-N 3.15Å; A236-F283 HydrophobicContact CB-CD1 4.35Å; A236-F283 HydrophobicContact CB-CD2 3.54Å; A236-F283 HydrophobicContact CB-CE1 4.11Å; A236-F283 HydrophobicContact CB-CE2 3.24Å; A236-F283 HydrophobicContact CB-CG 4.09Å; A236-F283 HydrophobicContact CB-CZ 3.56Å
237	K	83.8	Confident	84.7	Confident	67 Å²	67	35.6 Å²	35.6	29%	0.291	23%	0.226	S	C	.	.	H	α-helix	trans	-66	-42.8	172.6	-73.8	178.1	174.7	-172.8	0	112.2	P181 E183 T233 L234 L235 V239 A240 N241	P181-K237 HydrophobicContact CB-CB 3.81Å; P181-K237 HydrophobicContact CB-CD 4.33Å; P181-K237 HydrophobicContact CB-CG 4.1Å; P181-K237 HydrophobicContact CG-CB 3.86Å; P181-K237 HydrophobicContact CG-CG 4.28Å; P181-K237 WeakPolarHBondContact CG-O 3.34Å; E183-K237 VanDerWaalsContact OE1-CD 3.24Å; E183-K237 WeakPolarHBondContact OE1-CD 3.36Å; E183-K237 IonicContact OE1-NZ 3.21Å; E183-K237 PolarHBondContact OE1-NZ 3.37Å; T233-K237 WeakPolarHBondContact O-CG 3.12Å; T233-K237 PolarHBondContact O-N 3.38Å; T233-K237 VanDerWaalsContact O-N 3.12Å; L234-K237 PolarHBondContact O-N 2.9Å; L235-K237 VanDerWaalsContact C-N 3.3Å; L235-K237 PolarHBondContact O-N 3.35Å; K237-V239 VanDerWaalsContact C-N 3.28Å; K237-V239 PolarHBondContact O-N 3Å; K237-A240 WeakPolarHBondContact O-CB 3.48Å; K237-A240 PolarHBondContact O-N 2.92Å; K237-A240 VanDerWaalsContact O-N 3.1Å; K237-N241 PolarHBondContact O-N 3.11Å
238	A	86.3	Confident	84.7	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-38.8	177.5	0	0	0	0	0	112.3	E183 Y185 V188 L234 L235 N241 Q242	E183-A238 WeakPolarHBondContact O-CA 3.23Å; Y185-A238 HydrophobicContact CD1-CB 3.75Å; Y185-A238 HydrophobicContact CE1-CB 4.01Å; Y185-A238 HydrophobicContact CG-CB 4.47Å; V188-A238 HydrophobicContact CG2-CB 4.36Å; L234-A238 PolarHBondContact O-N 3.34Å; L235-A238 PolarHBondContact O-N 3.23Å; L235-A238 VanDerWaalsContact O-N 3.15Å; A238-N241 PolarHBondContact O-N 2.85Å; A238-Q242 WeakPolarHBondContact O-CG 3.35Å; A238-Q242 PolarHBondContact O-N 2.98Å
239	V	85.6	Confident	84.8	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-49.2	172.2	176.7	0	0	0	0	110.5	Y185 I198 L235 K237 N241 Q242 T243 I281 I328	Y185-V239 HydrophobicContact CE1-CG2 3.98Å; Y185-V239 WeakPolarHBondContact OH-CA 3.27Å; Y185-V239 VanDerWaalsContact OH-CG2 3.29Å; Y185-V239 WeakPolarHBondContact OH-CG2 3.34Å; I198-V239 HydrophobicContact CB-CG2 4.36Å; I198-V239 HydrophobicContact CD1-CG2 3.66Å; I198-V239 HydrophobicContact CG1-CG2 3.75Å; I198-V239 HydrophobicContact CG2-CG2 3.7Å; L235-V239 WeakPolarHBondContact O-CG2 3.5Å; L235-V239 PolarHBondContact O-N 3.43Å; K237-V239 VanDerWaalsContact C-N 3.28Å; K237-V239 PolarHBondContact O-N 3Å; V239-N241 PolarHBondContact O-N 3.48Å; V239-Q242 PolarHBondContact O-N 3.23Å; V239-T243 HydrophobicContact CG1-CG2 4.08Å; V239-T243 WeakPolarHBondContact O-CG2 3.21Å; V239-T243 PolarHBondContact O-N 3.44Å; V239-T243 PolarHBondContact O-OG1 3.02Å; V239-T243 VanDerWaalsContact O-OG1 3.05Å; V239-I281 HydrophobicContact CG1-CD1 4.27Å; V239-I328 HydrophobicContact CG1-CD1 4.41Å
240	A	82.3	Confident	85.1	Confident	5 Å²	5	31.8 Å²	31.8	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-30.6	-179.2	0	0	0	0	0	113.3	P181 A236 K237 T243 F247	P181-A240 HydrophobicContact CG-CB 3.8Å; A236-A240 PolarHBondContact O-N 2.99Å; A236-A240 VanDerWaalsContact O-N 3.15Å; K237-A240 WeakPolarHBondContact O-CB 3.48Å; K237-A240 PolarHBondContact O-N 2.92Å; K237-A240 VanDerWaalsContact O-N 3.1Å; A240-T243 VanDerWaalsContact O-O 3.06Å; A240-T243 PolarHBondContact O-OG1 2.97Å; A240-F247 HydrophobicContact CB-CB 4.11Å; A240-F247 HydrophobicContact CB-CD1 3.97Å; A240-F247 HydrophobicContact CB-CD2 3.41Å; A240-F247 VanDerWaalsContact CB-CD2 3.41Å; A240-F247 HydrophobicContact CB-CE1 4.2Å; A240-F247 HydrophobicContact CB-CE2 3.67Å; A240-F247 HydrophobicContact CB-CG 3.56Å; A240-F247 HydrophobicContact CB-CZ 4.05Å
241	N	83.8	Confident	85.2	Confident	54 Å²	54	32.1 Å²	32.1	29%	0.289	19%	0.185	S	C	.	.	H	α-helix	trans	-75.6	-34.6	176.2	-169.5	19.4	0	0	0	112.8	P181 E183 T184 K237 A238 V239	P181-N241 HydrophobicContact CG-CB 4.39Å; P181-N241 WeakPolarHBondContact O-CB 3.14Å; P181-N241 PolarHBondContact O-ND2 3.09Å; P181-N241 PolarHBondContact O-OD1 2.71Å; E183-N241 VanDerWaalsContact O-CB 3.27Å; E183-N241 WeakPolarHBondContact O-CB 3.31Å; E183-N241 PolarHBondContact O-ND2 2.92Å; T184-N241 WeakPolarHBondContact CG2-ND2 3.42Å; K237-N241 PolarHBondContact O-N 3.11Å; A238-N241 PolarHBondContact O-N 2.85Å; V239-N241 PolarHBondContact O-N 3.48Å
242	Q	83	Confident	85.2	Confident	86 Å²	86	30.7 Å²	30.7	40%	0.402	17%	0.17	S	C	.	.	H	α-helix	trans	-79.2	-29.9	177.8	-62.7	-135.4	-20.6	0	0	112.7	Y185 A238 V239	Y185-Q242 HydrophobicContact CD2-CG 3.78Å; Y185-Q242 HydrophobicContact CE2-CB 4.08Å; Y185-Q242 HydrophobicContact CE2-CG 3.55Å; A238-Q242 WeakPolarHBondContact O-CG 3.35Å; A238-Q242 PolarHBondContact O-N 2.98Å; V239-Q242 PolarHBondContact O-N 3.23Å
243	T	78	Confident	85.2	Confident	11 Å²	11	33.2 Å²	33.2	7%	0.067	19%	0.188	C	C	.	.			trans	-86	124.2	177.8	59	0	0	0	0	111	E202 L205 V239 A240 A245 I281	E202-T243 HydrophobicContact CB-CG2 4.27Å; E202-T243 HydrophobicContact CG-CG2 4.05Å; L205-T243 HydrophobicContact CD1-CG2 4.25Å; V239-T243 HydrophobicContact CG1-CG2 4.08Å; V239-T243 WeakPolarHBondContact O-CG2 3.21Å; V239-T243 PolarHBondContact O-N 3.44Å; V239-T243 PolarHBondContact O-OG1 3.02Å; V239-T243 VanDerWaalsContact O-OG1 3.05Å; A240-T243 VanDerWaalsContact O-O 3.06Å; A240-T243 PolarHBondContact O-OG1 2.97Å; T243-A245 PolarHBondContact O-N 3.27Å; T243-I281 HydrophobicContact CG2-CD1 3.88Å; T243-I281 WeakPolarHBondContact OG1-CD1 3.37Å
244	S	77.5	Confident	85.2	Confident	137 Å²	137	35.1 Å²	35.1	96%	0.958	19%	0.194	S	C	*	.			trans	-72.7	16.7	168.1	-52.4	0	0	0	0	113.7
245	A	79.7	Confident	85	Confident	17 Å²	17	32.4 Å²	32.4	14%	0.14	18%	0.18	C	C	.	.	S	Bend	trans	-84.3	156.9	180	0	0	0	0	0	110.7	L205 T243 F247 P279 I281	L205-A245 HydrophobicContact CD1-CB 4.1Å; T243-A245 PolarHBondContact O-N 3.27Å; A245-F247 PolarHBondContact O-N 2.94Å; A245-P279 WeakPolarHBondContact CB-O 3.41Å; A245-I281 HydrophobicContact CB-CD1 4.4Å; A245-I281 HydrophobicContact CB-CG1 4.31Å
246	T	83	Confident	84.8	Confident	41 Å²	41	35.5 Å²	35.5	25%	0.252	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127.4	176.2	57.1	0	0	0	0	110.2	H277 P279 S280 I281	T246-H277 HydrophobicContact CG2-CB 3.97Å; T246-H277 WeakPolarHBondContact OG1-CB 3.49Å; T246-H277 PolarHBondContact OG1-O 3.29Å; T246-P279 PolarHBondContact N-O 3.28Å; T246-P279 VanDerWaalsContact N-O 3.15Å; T246-P279 PolarHBondContact OG1-O 3.28Å; T246-S280 CarbonylContact O-C 3.46Å; T246-S280 VanDerWaalsContact O-CA 3.28Å; T246-S280 WeakPolarHBondContact O-CA 3.38Å; T246-S280 WeakPolarHBondContact OG1-CA 3.18Å; T246-S280 WeakPolarHBondContact OG1-CB 3.28Å; T246-I281 PolarHBondContact O-N 3.37Å
247	F	86.9	Confident	84.8	Confident	12 Å²	12	38.3 Å²	38.3	5%	0.053	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.9	-177.2	-174.3	-103.5	0	0	0	110.6	L177 A240 A245 R249 I281 F283	L177-F247 HydrophobicContact CB-CD1 4.26Å; L177-F247 HydrophobicContact CD1-CD1 3.46Å; L177-F247 VanDerWaalsContact CD1-CD1 3.46Å; L177-F247 HydrophobicContact CD1-CE1 3.57Å; L177-F247 HydrophobicContact CG-CD1 4.48Å; L177-F247 PolarHBondContact N-O 3.29Å; A240-F247 HydrophobicContact CB-CB 4.11Å; A240-F247 HydrophobicContact CB-CD1 3.97Å; A240-F247 HydrophobicContact CB-CD2 3.41Å; A240-F247 VanDerWaalsContact CB-CD2 3.41Å; A240-F247 HydrophobicContact CB-CE1 4.2Å; A240-F247 HydrophobicContact CB-CE2 3.67Å; A240-F247 HydrophobicContact CB-CG 3.56Å; A240-F247 HydrophobicContact CB-CZ 4.05Å; A245-F247 PolarHBondContact O-N 2.94Å; F247-R249 HydrophobicContact CD1-CB 4.47Å; F247-R249 HydrophobicContact CE1-CB 3.9Å; F247-I281 HydrophobicContact CD2-CB 4.11Å; F247-I281 HydrophobicContact CD2-CG2 4.04Å; F247-I281 HydrophobicContact CE2-CG2 4.17Å; F247-F283 HydrophobicContact CE1-CB 4.29Å; F247-F283 HydrophobicContact CE2-CB 3.5Å; F247-F283 VanDerWaalsContact CE2-CB 3.5Å; F247-F283 HydrophobicContact CE2-CG 4.25Å; F247-F283 HydrophobicContact CZ-CB 3.33Å; F247-F283 AromaticContact CZ-CD1 3.9Å; F247-F283 HydrophobicContact CZ-CD1 3.9Å; F247-F283 AromaticContact CZ-CG 3.78Å; F247-F283 HydrophobicContact CZ-CG 3.78Å
248	L	88.1	Confident	84.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.3	177.1	-64.7	167.6	0	0	0	107.9	K176 L270 V273 A274 I281 V282 F283	K176-L248 HydrophobicContact CB-CD2 3.97Å; K176-L248 HydrophobicContact CG-CD2 4.24Å; L248-L270 HydrophobicContact CB-CD1 4.44Å; L248-L270 HydrophobicContact CD1-CD1 4.46Å; L248-V273 HydrophobicContact CD2-CG1 4.48Å; L248-A274 HydrophobicContact CD1-CB 3.44Å; L248-A274 VanDerWaalsContact CD1-CB 3.44Å; L248-I281 PolarHBondContact N-O 3.05Å; L248-V282 HydrophobicContact CB-CG2 4.45Å; L248-V282 HydrophobicContact CD1-CG2 4.08Å; L248-F283 PolarHBondContact O-N 3.1Å
249	R	89.7	Confident	84.7	Confident	73 Å²	73	52.7 Å²	52.7	28%	0.275	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.1	176.8	172.7	179.7	168.8	90	9.2	109.1	M175 L177 F247 F283 D285	M175-R249 PolarHBondContact O-N 3.24Å; L177-R249 HydrophobicContact CD1-CB 3.49Å; L177-R249 VanDerWaalsContact CD1-CB 3.49Å; L177-R249 HydrophobicContact CD1-CG 4.38Å; F247-R249 HydrophobicContact CD1-CB 4.47Å; F247-R249 HydrophobicContact CE1-CB 3.9Å; R249-F283 HydrophobicContact CG-CD1 4.24Å; R249-D285 IonicContact CZ-OD2 3.75Å; R249-D285 IonicContact NH1-OD2 2.97Å; R249-D285 PolarHBondContact NH1-OD2 3.45Å; R249-D285 IonicContact NH2-OD2 2.99Å; R249-D285 PolarHBondContact NH2-OD2 3.21Å
250	V	89.4	Confident	84.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.3	173.9	-176	0	0	0	0	108.8	M175 L255 L270 F283 I284 D285	M175-V250 HydrophobicContact CB-CG2 4.16Å; M175-V250 HydrophobicContact CE-CG1 4.39Å; M175-V250 HydrophobicContact CG-CG2 4.04Å; M175-V250 HydrophobicContact SD-CG1 4.47Å; M175-V250 HydrophobicContact SD-CG2 3.57Å; M175-V250 VanDerWaalsContact SD-CG2 3.57Å; V250-L255 HydrophobicContact CG1-CD1 4.44Å; V250-L255 HydrophobicContact CG1-CD2 3.89Å; V250-L255 HydrophobicContact CG1-CG 3.96Å; V250-L270 HydrophobicContact CG2-CD1 3.62Å; V250-L270 HydrophobicContact CG2-CD2 3.73Å; V250-L270 HydrophobicContact CG2-CG 4.33Å; V250-F283 PolarHBondContact N-O 2.96Å; V250-I284 WeakPolarHBondContact O-CA 3.34Å; V250-D285 PolarHBondContact O-N 2.85Å
251	V	89.2	Confident	84.8	Confident	22 Å²	22	60.4 Å²	60.4	13%	0.133	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.2	170.5	-173.1	0	0	0	0	108.3	S253 E254	V251-S253 WeakPolarHBondContact CG1-OG 3.4Å; V251-S253 PolarHBondContact O-N 3.38Å; V251-E254 HydrophobicContact CB-CG 4.06Å; V251-E254 PolarHBondContact N-OE2 2.81Å; V251-E254 VanDerWaalsContact N-OE2 3.14Å; V251-E254 WeakPolarHBondContact O-CB 3.22Å; V251-E254 PolarHBondContact O-N 3.42Å
252	G	86.2	Confident	85	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-54.1	-32	-176.5	0	0	0	0	0	113.4	E254 L255 D285 I290	G252-E254 VanDerWaalsContact C-N 3.34Å; G252-E254 PolarHBondContact O-N 3.44Å; G252-L255 PolarHBondContact O-N 2.96Å; G252-D285 PolarHBondContact N-O 3.39Å; G252-I290 WeakPolarHBondContact O-CG2 2.96Å
253	S	86.7	Confident	85.2	Confident	61 Å²	61	56.8 Å²	56.8	43%	0.427	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-67.6	-26.8	174.7	56.7	0	0	0	0	114.6	V251 L255 I256	V251-S253 WeakPolarHBondContact CG1-OG 3.4Å; V251-S253 PolarHBondContact O-N 3.38Å; S253-L255 PolarHBondContact O-N 2.81Å; S253-I256 PolarHBondContact O-N 3.49Å
254	E	86.8	Confident	85.7	Confident	89 Å²	89	56.5 Å²	56.5	42%	0.416	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-71.8	-20.9	179.6	-66.7	170	171.1	0	0	112.3	V251 G252 I256 Q257	V251-E254 HydrophobicContact CB-CG 4.06Å; V251-E254 PolarHBondContact N-OE2 2.81Å; V251-E254 VanDerWaalsContact N-OE2 3.14Å; V251-E254 WeakPolarHBondContact O-CB 3.22Å; V251-E254 PolarHBondContact O-N 3.42Å; G252-E254 VanDerWaalsContact C-N 3.34Å; G252-E254 PolarHBondContact O-N 3.44Å; E254-I256 PolarHBondContact O-N 3.35Å; E254-Q257 PolarHBondContact O-NE2 2.9Å
255	L	84.8	Confident	86.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-73.6	-10.9	174.6	-62.2	176.4	0	0	0	112.6	V250 G252 S253 L266 V267 I290 T308	V250-L255 HydrophobicContact CG1-CD1 4.44Å; V250-L255 HydrophobicContact CG1-CD2 3.89Å; V250-L255 HydrophobicContact CG1-CG 3.96Å; G252-L255 PolarHBondContact O-N 2.96Å; S253-L255 PolarHBondContact O-N 2.81Å; L255-L266 HydrophobicContact CD2-CD2 4.32Å; L255-V267 HydrophobicContact CD2-CG2 3.94Å; L255-I290 HydrophobicContact CD1-CD1 3.83Å; L255-T308 HydrophobicContact CB-CG2 4.28Å
256	I	84.8	Confident	86.7	Confident	67 Å²	67	55 Å²	55	34%	0.344	27%	0.269	S	S	.	.			trans	-91.8	106.2	178	-54.3	176.5	0	0	0	109	S253 E254 I290 I305	S253-I256 PolarHBondContact O-N 3.49Å; E254-I256 PolarHBondContact O-N 3.35Å; I256-I290 HydrophobicContact CD1-CG2 3.82Å; I256-I290 HydrophobicContact CG1-CG2 3.58Å; I256-I305 HydrophobicContact CD1-CD1 4.2Å; I256-I305 HydrophobicContact CD1-CG1 4.43Å; I256-I305 HydrophobicContact CG1-CG1 4.31Å; I256-I305 HydrophobicContact CG2-CD1 4.1Å; I256-I305 HydrophobicContact CG2-CG1 4.05Å
257	Q	85.1	Confident	87	Confident	58 Å²	58	53 Å²	53	27%	0.271	26%	0.257	S	S	.	.			trans	-103.4	154.9	179.6	-65.1	-60.5	-27.2	0	0	112.1	E254 D262 L266	E254-Q257 PolarHBondContact O-NE2 2.9Å; Q257-D262 HydrophobicContact CB-CB 3.74Å; Q257-D262 HydrophobicContact CG-CB 4.06Å; Q257-L266 HydrophobicContact CG-CD2 4.5Å
258	K	83.3	Confident	87	Confident	198 Å²	198	58.5 Å²	58.5	86%	0.861	28%	0.277	S	S	*	.	S	Bend	trans	-74.7	-28.5	-178.9	-66.4	-179.1	-177.3	175.9	0	112.9
259	Y	85	Confident	86.9	Confident	171 Å²	171	60.1 Å²	60.1	67%	0.671	28%	0.284	S	S	*	.	S	Bend	trans	-95.2	141.6	-179.4	-58.2	-75.4	0	0	0	110.8	G261 D262	Y259-G261 PolarHBondContact O-N 3.22Å; Y259-D262 WeakPolarHBondContact CB-OD2 3.49Å
260	L	84.6	Confident	86.9	Confident	144 Å²	144	56.7 Å²	56.7	75%	0.754	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	129.8	178.7	-83	72.3	0	0	0	110.2
261	G	85.5	Confident	86.8	Confident	24 Å²	24	57.4 Å²	57.4	25%	0.247	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	-17.8	178.1	0	0	0	0	0	114.8	Y259 G263 P264 K265 E304	Y259-G261 PolarHBondContact O-N 3.22Å; G261-G263 VanDerWaalsContact C-N 3.35Å; G261-G263 PolarHBondContact O-N 3.46Å; G261-P264 WeakPolarHBondContact O-CD 3.22Å; G261-K265 PolarHBondContact O-N 2.89Å; G261-E304 PolarHBondContact N-OE1 3.34Å
262	D	87.1	Confident	86.6	Confident	64 Å²	64	61.5 Å²	61.5	34%	0.342	29%	0.288	S	S	.	.	H	α-helix	trans	-68.3	-35.5	179.2	-78.4	3.4	0	0	0	111.7	Q257 Y259 K265 L266	Q257-D262 HydrophobicContact CB-CB 3.74Å; Q257-D262 HydrophobicContact CG-CB 4.06Å; Y259-D262 WeakPolarHBondContact CB-OD2 3.49Å; D262-K265 PolarHBondContact O-N 2.83Å; D262-L266 WeakPolarHBondContact O-CB 3.49Å; D262-L266 PolarHBondContact O-N 3.28Å
263	G	87.5	Confident	86.6	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-58	-57.8	177.3	0	0	0	0	0	112.6	G261 K265 L266 V267	G261-G263 VanDerWaalsContact C-N 3.35Å; G261-G263 PolarHBondContact O-N 3.46Å; G263-K265 VanDerWaalsContact C-N 3.31Å; G263-K265 PolarHBondContact O-N 2.82Å; G263-L266 PolarHBondContact O-N 3.12Å; G263-V267 WeakPolarHBondContact O-CG2 3.42Å; G263-V267 PolarHBondContact O-N 2.92Å; G263-V267 VanDerWaalsContact O-N 3.14Å
264	P	89.2	Confident	86.5	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.032	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-36.9	175.1	-25.9	34.7	0	0	0	113.9	G261 V267 R268 R307 T308 E311	G261-P264 WeakPolarHBondContact O-CD 3.22Å; P264-V267 PolarHBondContact O-N 2.88Å; P264-R268 WeakPolarHBondContact O-CG 3.49Å; P264-R268 PolarHBondContact O-N 3.21Å; P264-R268 VanDerWaalsContact O-N 3.15Å; P264-R307 HydrophobicContact CG-CG 4.03Å; P264-T308 WeakPolarHBondContact CD-OG1 3.29Å; P264-E311 HydrophobicContact CB-CB 4.03Å; P264-E311 HydrophobicContact CB-CG 4.01Å
265	K	88.8	Confident	86.5	Confident	109 Å²	109	58.9 Å²	58.9	47%	0.474	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-47.6	177.5	-173.2	-172.4	173.1	-159.6	0	111	G261 D262 G263 V267 R268 E269	G261-K265 PolarHBondContact O-N 2.89Å; D262-K265 PolarHBondContact O-N 2.83Å; G263-K265 VanDerWaalsContact C-N 3.31Å; G263-K265 PolarHBondContact O-N 2.82Å; K265-V267 VanDerWaalsContact C-N 3.32Å; K265-V267 PolarHBondContact O-N 3.12Å; K265-R268 WeakPolarHBondContact O-CB 3.43Å; K265-R268 PolarHBondContact O-N 3.15Å; K265-R268 VanDerWaalsContact O-N 3.14Å; K265-E269 VanDerWaalsContact CE-OE1 3.27Å; K265-E269 WeakPolarHBondContact CE-OE1 3.44Å; K265-E269 IonicContact NZ-OE1 3.3Å; K265-E269 PolarHBondContact O-N 3.4Å
266	L	88.5	Confident	86.4	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.063	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-41.4	178.6	-176.7	63.3	0	0	0	112	M171 V172 M175 L255 Q257 D262 G263 R268 E269 L270	M171-L266 HydrophobicContact CB-CD1 4.4Å; V172-L266 HydrophobicContact CG2-CD1 4.3Å; M175-L266 HydrophobicContact CE-CD1 3.84Å; M175-L266 HydrophobicContact CE-CD2 3.9Å; M175-L266 HydrophobicContact CE-CG 4.08Å; L255-L266 HydrophobicContact CD2-CD2 4.32Å; Q257-L266 HydrophobicContact CG-CD2 4.5Å; D262-L266 WeakPolarHBondContact O-CB 3.49Å; D262-L266 PolarHBondContact O-N 3.28Å; G263-L266 PolarHBondContact O-N 3.12Å; L266-R268 VanDerWaalsContact C-N 3.34Å; L266-R268 PolarHBondContact O-N 3.14Å; L266-E269 PolarHBondContact O-N 3.32Å; L266-L270 WeakPolarHBondContact O-CB 3.18Å; L266-L270 PolarHBondContact O-N 3.43Å
267	V	89.3	Confident	86.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-42.7	175.6	173.8	0	0	0	0	111.1	L255 G263 P264 K265 L270 F271 T308 E311 L312 Q315	L255-V267 HydrophobicContact CD2-CG2 3.94Å; G263-V267 WeakPolarHBondContact O-CG2 3.42Å; G263-V267 PolarHBondContact O-N 2.92Å; G263-V267 VanDerWaalsContact O-N 3.14Å; P264-V267 PolarHBondContact O-N 2.88Å; K265-V267 VanDerWaalsContact C-N 3.32Å; K265-V267 PolarHBondContact O-N 3.12Å; V267-L270 PolarHBondContact O-N 2.96Å; V267-F271 HydrophobicContact CG1-CD2 4.17Å; V267-F271 HydrophobicContact CG1-CE2 4.21Å; V267-F271 WeakPolarHBondContact O-CD2 3.41Å; V267-F271 PolarHBondContact O-N 3.23Å; V267-T308 HydrophobicContact CG2-CG2 3.84Å; V267-E311 HydrophobicContact CB-CG 4.39Å; V267-E311 HydrophobicContact CG1-CG 4.26Å; V267-L312 HydrophobicContact CG1-CB 4.12Å; V267-L312 HydrophobicContact CG1-CD1 4.13Å; V267-Q315 HydrophobicContact CG1-CB 4.31Å; V267-Q315 HydrophobicContact CG1-CG 4.07Å
268	R	87.7	Confident	86.2	Confident	127 Å²	127	62 Å²	62	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-43.7	176.9	-69.9	176.6	-171	155.9	7.9	112.2	P264 K265 L266 F271 R272 E311	P264-R268 WeakPolarHBondContact O-CG 3.49Å; P264-R268 PolarHBondContact O-N 3.21Å; P264-R268 VanDerWaalsContact O-N 3.15Å; K265-R268 WeakPolarHBondContact O-CB 3.43Å; K265-R268 PolarHBondContact O-N 3.15Å; K265-R268 VanDerWaalsContact O-N 3.14Å; L266-R268 VanDerWaalsContact C-N 3.34Å; L266-R268 PolarHBondContact O-N 3.14Å; R268-F271 PolarHBondContact O-N 3.46Å; R268-R272 WeakPolarHBondContact O-CB 3.37Å; R268-R272 PolarHBondContact O-N 3.45Å; R268-E311 HydrophobicContact CG-CG 4.25Å; R268-E311 VanDerWaalsContact CG-OE1 3.27Å; R268-E311 WeakPolarHBondContact CG-OE1 3.13Å; R268-E311 IonicContact CZ-OE1 3.11Å; R268-E311 IonicContact CZ-OE2 3.9Å; R268-E311 IonicContact NE-OE1 3.08Å; R268-E311 PolarHBondContact NE-OE1 3.12Å; R268-E311 IonicContact NE-OE2 3.25Å; R268-E311 PolarHBondContact NE-OE2 3.47Å; R268-E311 IonicContact NH2-OE1 2.77Å; R268-E311 IonicContact NH2-OE2 3.85Å; R268-E311 PolarHBondContact NH2-OE2 2.98Å
269	E	86.6	Confident	86.2	Confident	36 Å²	36	55.4 Å²	55.4	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-39.2	178.1	-70.8	-160	-160.9	0	0	112.3	D169 V172 K265 L266 F271 R272 V273	D169-E269 WeakPolarHBondContact CB-OE2 3.49Å; V172-E269 HydrophobicContact CG2-CB 3.96Å; K265-E269 VanDerWaalsContact CE-OE1 3.27Å; K265-E269 WeakPolarHBondContact CE-OE1 3.44Å; K265-E269 IonicContact NZ-OE1 3.3Å; K265-E269 PolarHBondContact O-N 3.4Å; L266-E269 PolarHBondContact O-N 3.32Å; E269-F271 PolarHBondContact O-N 2.91Å; E269-R272 WeakPolarHBondContact O-CB 3.44Å; E269-R272 PolarHBondContact O-N 3.48Å; E269-V273 WeakPolarHBondContact O-CG2 3.37Å; E269-V273 PolarHBondContact O-N 3.24Å
270	L	88.2	Confident	86.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-55.2	-49.4	174.5	176.3	67.4	0	0	0	111.9	M175 L248 V250 L266 V267 V273 A274 V282	M175-L270 HydrophobicContact SD-CD1 3.89Å; L248-L270 HydrophobicContact CB-CD1 4.44Å; L248-L270 HydrophobicContact CD1-CD1 4.46Å; V250-L270 HydrophobicContact CG2-CD1 3.62Å; V250-L270 HydrophobicContact CG2-CD2 3.73Å; V250-L270 HydrophobicContact CG2-CG 4.33Å; L266-L270 WeakPolarHBondContact O-CB 3.18Å; L266-L270 PolarHBondContact O-N 3.43Å; V267-L270 PolarHBondContact O-N 2.96Å; L270-V273 PolarHBondContact O-N 2.87Å; L270-A274 WeakPolarHBondContact O-CB 3.45Å; L270-A274 PolarHBondContact O-N 3.36Å; L270-V282 HydrophobicContact CD2-CG1 4.16Å
271	F	88.2	Confident	86.3	Confident	15 Å²	15	40.4 Å²	40.4	7%	0.066	20%	0.197	C	C	.	.	H	α-helix	trans	-70.5	-33.8	178.8	-81.7	-82	0	0	0	112.6	V267 R268 E269 A274 E275 L312 Q315 L316 V327	V267-F271 HydrophobicContact CG1-CD2 4.17Å; V267-F271 HydrophobicContact CG1-CE2 4.21Å; V267-F271 WeakPolarHBondContact O-CD2 3.41Å; V267-F271 PolarHBondContact O-N 3.23Å; R268-F271 PolarHBondContact O-N 3.46Å; E269-F271 PolarHBondContact O-N 2.91Å; F271-A274 WeakPolarHBondContact O-CB 3.48Å; F271-A274 PolarHBondContact O-N 2.99Å; F271-E275 WeakPolarHBondContact O-CB 3.47Å; F271-E275 PolarHBondContact O-N 2.91Å; F271-L312 HydrophobicContact CE2-CD1 3.66Å; F271-L312 HydrophobicContact CZ-CD1 4.09Å; F271-Q315 HydrophobicContact CD2-CB 3.5Å; F271-Q315 HydrophobicContact CD2-CG 4.11Å; F271-Q315 WeakPolarHBondContact CE1-O 3.46Å; F271-Q315 HydrophobicContact CE2-CB 3.67Å; F271-Q315 HydrophobicContact CG-CB 4.01Å; F271-Q315 HydrophobicContact CZ-CB 4.3Å; F271-L316 HydrophobicContact CE1-CD2 4.33Å; F271-L316 HydrophobicContact CZ-CD2 3.82Å; F271-L316 HydrophobicContact CZ-CG 4.44Å; F271-V327 HydrophobicContact CE1-CG2 4.14Å; F271-V327 HydrophobicContact CZ-CG2 4.48Å
272	R	85.2	Confident	86.5	Confident	108 Å²	108	39.3 Å²	39.3	41%	0.408	19%	0.185	S	C	.	.	H	α-helix	trans	-60.6	-47.9	173.1	179.4	-176	168.1	-178.6	0.7	111.3	R268 E269 A274 E275 E276	R268-R272 WeakPolarHBondContact O-CB 3.37Å; R268-R272 PolarHBondContact O-N 3.45Å; E269-R272 WeakPolarHBondContact O-CB 3.44Å; E269-R272 PolarHBondContact O-N 3.48Å; R272-A274 VanDerWaalsContact C-N 3.32Å; R272-A274 PolarHBondContact O-N 2.9Å; R272-E275 PolarHBondContact O-N 2.79Å; R272-E276 WeakPolarHBondContact CG-OE1 3.02Å; R272-E276 IonicContact CZ-OE1 3.57Å; R272-E276 IonicContact NE-OE1 3.6Å; R272-E276 PolarHBondContact NE-OE1 3.36Å; R272-E276 IonicContact NH2-OE1 3.8Å; R272-E276 WeakPolarHBondContact O-CG 3.4Å; R272-E276 PolarHBondContact O-N 3.15Å
273	V	84.8	Confident	86.7	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-38.9	177.6	173.1	0	0	0	0	111	T168 V172 L248 E269 L270 E275 E276 H277	T168-V273 HydrophobicContact CG2-CG2 3.63Å; V172-V273 HydrophobicContact CB-CG2 4.25Å; V172-V273 HydrophobicContact CG1-CB 3.73Å; V172-V273 HydrophobicContact CG1-CG1 3.93Å; V172-V273 HydrophobicContact CG1-CG2 3.57Å; L248-V273 HydrophobicContact CD2-CG1 4.48Å; E269-V273 WeakPolarHBondContact O-CG2 3.37Å; E269-V273 PolarHBondContact O-N 3.24Å; L270-V273 PolarHBondContact O-N 2.87Å; V273-E275 VanDerWaalsContact C-N 3.33Å; V273-E275 PolarHBondContact O-N 2.89Å; V273-E276 PolarHBondContact O-N 3.31Å; V273-H277 WeakPolarHBondContact O-CB 3.28Å; V273-H277 PolarHBondContact O-N 3.01Å; V273-H277 VanDerWaalsContact O-N 3.11Å; V273-H277 PolarHBondContact O-ND1 3.34Å
274	A	86.5	Confident	86.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-40.7	174.6	0	0	0	0	0	112.4	L248 L270 F271 R272 H277 S278 S280 V282 V325	L248-A274 HydrophobicContact CD1-CB 3.44Å; L248-A274 VanDerWaalsContact CD1-CB 3.44Å; L270-A274 WeakPolarHBondContact O-CB 3.45Å; L270-A274 PolarHBondContact O-N 3.36Å; F271-A274 WeakPolarHBondContact O-CB 3.48Å; F271-A274 PolarHBondContact O-N 2.99Å; R272-A274 VanDerWaalsContact C-N 3.32Å; R272-A274 PolarHBondContact O-N 2.9Å; A274-H277 CarbonylContact O-C 3.56Å; A274-S278 PolarHBondContact O-N 3.07Å; A274-S280 WeakPolarHBondContact O-CB 3.44Å; A274-S280 PolarHBondContact O-OG 3.21Å; A274-V282 HydrophobicContact CB-CG2 3.72Å; A274-V325 HydrophobicContact CB-CG1 3.99Å; A274-V325 HydrophobicContact CB-CG2 4.43Å
275	E	85.5	Confident	87	Confident	93 Å²	93	36.5 Å²	36.5	44%	0.435	17%	0.17	S	C	.	.	H	α-helix	trans	-69.9	-42.1	178	-172.3	176	-163.4	0	0	112	F271 R272 V273 H277 S278	F271-E275 WeakPolarHBondContact O-CB 3.47Å; F271-E275 PolarHBondContact O-N 2.91Å; R272-E275 PolarHBondContact O-N 2.79Å; V273-E275 VanDerWaalsContact C-N 3.33Å; V273-E275 PolarHBondContact O-N 2.89Å; E275-H277 PolarHBondContact O-N 3.25Å; E275-S278 VanDerWaalsContact O-CB 3.32Å; E275-S278 WeakPolarHBondContact O-CB 3.48Å; E275-S278 PolarHBondContact O-N 3.23Å
276	E	83.7	Confident	87	Confident	84 Å²	84	35.6 Å²	35.6	39%	0.393	17%	0.167	S	C	.	.	H	α-helix	trans	-63.2	-28.5	177.2	-73.4	172.3	-175.8	0	0	112.5	K38 R272 V273	K38-E276 IonicContact NZ-OE1 2.76Å; K38-E276 PolarHBondContact NZ-OE1 3.36Å; R272-E276 WeakPolarHBondContact CG-OE1 3.02Å; R272-E276 IonicContact CZ-OE1 3.57Å; R272-E276 IonicContact NE-OE1 3.6Å; R272-E276 PolarHBondContact NE-OE1 3.36Å; R272-E276 IonicContact NH2-OE1 3.8Å; R272-E276 WeakPolarHBondContact O-CG 3.4Å; R272-E276 PolarHBondContact O-N 3.15Å; V273-E276 PolarHBondContact O-N 3.31Å
277	H	83.4	Confident	87.1	Confident	61 Å²	61	35.1 Å²	35.1	28%	0.282	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	18.4	178	-66.7	89.3	0	0	0	114.4	K176 T246 V273 A274 E275 P279	K176-H277 PolarHBondContact NZ-CD2 3.25Å; K176-H277 PolarHBondContact NZ-NE2 3.49Å; T246-H277 HydrophobicContact CG2-CB 3.97Å; T246-H277 WeakPolarHBondContact OG1-CB 3.49Å; T246-H277 PolarHBondContact OG1-O 3.29Å; V273-H277 WeakPolarHBondContact O-CB 3.28Å; V273-H277 PolarHBondContact O-N 3.01Å; V273-H277 VanDerWaalsContact O-N 3.11Å; V273-H277 PolarHBondContact O-ND1 3.34Å; A274-H277 CarbonylContact O-C 3.56Å; E275-H277 PolarHBondContact O-N 3.25Å; H277-P279 CarbonylContact O-C 3.53Å
278	S	81.2	Confident	87	Confident	46 Å²	46	36.5 Å²	36.5	32%	0.322	17%	0.172	S	C	.	.			trans	-57.7	134.4	178.4	179.7	0	0	0	0	112	A274 E275 D324	A274-S278 PolarHBondContact O-N 3.07Å; E275-S278 VanDerWaalsContact O-CB 3.32Å; E275-S278 WeakPolarHBondContact O-CB 3.48Å; E275-S278 PolarHBondContact O-N 3.23Å; S278-D324 PolarHBondContact OG-N 2.81Å
279	P	84.3	Confident	86.8	Confident	60 Å²	60	32 Å²	32	39%	0.39	16%	0.162	S	C	.	.	S	Bend	cis	-76	134.9	3.7	30.2	-34.5	0	0	0	113.4	L205 A245 T246 H277 D324	L205-P279 HydrophobicContact CD2-CB 3.65Å; A245-P279 WeakPolarHBondContact CB-O 3.41Å; T246-P279 PolarHBondContact N-O 3.28Å; T246-P279 VanDerWaalsContact N-O 3.15Å; T246-P279 PolarHBondContact OG1-O 3.28Å; H277-P279 CarbonylContact O-C 3.53Å; P279-D324 WeakPolarHBondContact CA-O 3.47Å; P279-D324 HydrophobicContact CB-CB 3.94Å
280	S	85.1	Confident	86.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.7	-175	67.9	0	0	0	0	113	T246 A274 D324 V325 K326	T246-S280 CarbonylContact O-C 3.46Å; T246-S280 VanDerWaalsContact O-CA 3.28Å; T246-S280 WeakPolarHBondContact O-CA 3.38Å; T246-S280 WeakPolarHBondContact OG1-CA 3.18Å; T246-S280 WeakPolarHBondContact OG1-CB 3.28Å; A274-S280 WeakPolarHBondContact O-CB 3.44Å; A274-S280 PolarHBondContact O-OG 3.21Å; S280-D324 PolarHBondContact N-O 3.01Å; S280-V325 WeakPolarHBondContact O-CA 3.2Å; S280-K326 PolarHBondContact O-N 3.47Å
281	I	87	Confident	85.9	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.1	176.5	-58.6	176.2	0	0	0	108	L205 V239 T243 A245 T246 F247 L248 K326 I328	L205-I281 HydrophobicContact CD1-CD1 4.37Å; V239-I281 HydrophobicContact CG1-CD1 4.27Å; T243-I281 HydrophobicContact CG2-CD1 3.88Å; T243-I281 WeakPolarHBondContact OG1-CD1 3.37Å; A245-I281 HydrophobicContact CB-CD1 4.4Å; A245-I281 HydrophobicContact CB-CG1 4.31Å; T246-I281 PolarHBondContact O-N 3.37Å; F247-I281 HydrophobicContact CD2-CB 4.11Å; F247-I281 HydrophobicContact CD2-CG2 4.04Å; F247-I281 HydrophobicContact CE2-CG2 4.17Å; L248-I281 PolarHBondContact N-O 3.05Å; I281-K326 CarbonylContact C-O 3.58Å; I281-K326 WeakPolarHBondContact CA-O 3.16Å; I281-K326 HydrophobicContact CG1-CB 4.39Å; I281-I328 HydrophobicContact CG2-CD1 3.8Å; I281-I328 HydrophobicContact CG2-CG1 4.16Å
282	V	89.7	Confident	85.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	112	174.8	-177.2	0	0	0	0	108.5	L248 L270 A274 I284 V325 K326 V327 I328	L248-V282 HydrophobicContact CB-CG2 4.45Å; L248-V282 HydrophobicContact CD1-CG2 4.08Å; L270-V282 HydrophobicContact CD2-CG1 4.16Å; A274-V282 HydrophobicContact CB-CG2 3.72Å; V282-I284 HydrophobicContact CG1-CG1 4.16Å; V282-V325 HydrophobicContact CG2-CG1 3.94Å; V282-K326 PolarHBondContact N-O 3.25Å; V282-V327 HydrophobicContact CB-CG2 4.49Å; V282-V327 WeakPolarHBondContact O-CA 3.25Å; V282-I328 PolarHBondContact O-N 3.31Å
283	F	91	Very high	84.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	115.7	176	179.2	-115.2	0	0	0	110.9	T233 A236 F247 L248 R249 V250 D285 I328 A330	T233-F283 HydrophobicContact CG2-CE1 4.26Å; T233-F283 HydrophobicContact CG2-CZ 4.46Å; A236-F283 HydrophobicContact CB-CD1 4.35Å; A236-F283 HydrophobicContact CB-CD2 3.54Å; A236-F283 HydrophobicContact CB-CE1 4.11Å; A236-F283 HydrophobicContact CB-CE2 3.24Å; A236-F283 HydrophobicContact CB-CG 4.09Å; A236-F283 HydrophobicContact CB-CZ 3.56Å; F247-F283 HydrophobicContact CE1-CB 4.29Å; F247-F283 HydrophobicContact CE2-CB 3.5Å; F247-F283 VanDerWaalsContact CE2-CB 3.5Å; F247-F283 HydrophobicContact CE2-CG 4.25Å; F247-F283 HydrophobicContact CZ-CB 3.33Å; F247-F283 AromaticContact CZ-CD1 3.9Å; F247-F283 HydrophobicContact CZ-CD1 3.9Å; F247-F283 AromaticContact CZ-CG 3.78Å; F247-F283 HydrophobicContact CZ-CG 3.78Å; L248-F283 PolarHBondContact O-N 3.1Å; R249-F283 HydrophobicContact CG-CD1 4.24Å; V250-F283 PolarHBondContact N-O 2.96Å; F283-D285 HydrophobicContact CD1-CB 4.46Å; F283-D285 HydrophobicContact CE1-CB 3.7Å; F283-D285 HydrophobicContact CZ-CB 4.05Å; F283-I328 CarbonylContact C-O 3.32Å; F283-I328 WeakPolarHBondContact CA-O 3.35Å; F283-I328 HydrophobicContact CD2-CB 3.9Å; F283-I328 HydrophobicContact CD2-CG2 3.68Å; F283-I328 WeakPolarHBondContact CD2-O 3.32Å; F283-I328 HydrophobicContact CE2-CG2 3.97Å; F283-A330 HydrophobicContact CE2-CB 3.93Å; F283-A330 HydrophobicContact CZ-CB 3.93Å
284	I	91.1	Very high	83.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	105.8	176.7	-55	175.4	0	0	0	108.3	V250 V282 I287 L312 V327 I328 M329 A330	V250-I284 WeakPolarHBondContact O-CA 3.34Å; V282-I284 HydrophobicContact CG1-CG1 4.16Å; I284-I287 HydrophobicContact CG2-CB 4.18Å; I284-I287 HydrophobicContact CG2-CD1 4.35Å; I284-I287 HydrophobicContact CG2-CG1 4.32Å; I284-L312 HydrophobicContact CD1-CD1 3.97Å; I284-L312 HydrophobicContact CD1-CD2 4.25Å; I284-V327 HydrophobicContact CD1-CG1 4.46Å; I284-I328 PolarHBondContact N-O 2.93Å; I284-M329 HydrophobicContact CB-CG 4.22Å; I284-M329 HydrophobicContact CD1-CG 4.47Å; I284-M329 CarbonylContact O-C 3.53Å; I284-M329 WeakPolarHBondContact O-CA 3.37Å; I284-A330 PolarHBondContact O-N 3.05Å
285	D	91	Very high	81.9	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.064	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	148.9	177	-143	-7.9	0	0	0	110.1	T233 R249 V250 G252 F283 I287	T233-D285 VanDerWaalsContact CG2-OD2 3.26Å; T233-D285 WeakPolarHBondContact CG2-OD2 3.48Å; T233-D285 PolarHBondContact OG1-OD1 3.02Å; T233-D285 PolarHBondContact OG1-OD2 3.47Å; R249-D285 IonicContact CZ-OD2 3.75Å; R249-D285 IonicContact NH1-OD2 2.97Å; R249-D285 PolarHBondContact NH1-OD2 3.45Å; R249-D285 IonicContact NH2-OD2 2.99Å; R249-D285 PolarHBondContact NH2-OD2 3.21Å; V250-D285 PolarHBondContact O-N 2.85Å; G252-D285 PolarHBondContact N-O 3.39Å; F283-D285 HydrophobicContact CD1-CB 4.46Å; F283-D285 HydrophobicContact CE1-CB 3.7Å; F283-D285 HydrophobicContact CZ-CB 4.05Å; D285-I287 PolarHBondContact O-N 3.35Å
286	E	89.4	Confident	80.6	Confident	90 Å²	90	49.4 Å²	49.4	42%	0.421	24%	0.24	S	C	.	.			trans	50.3	47.1	175.1	-57.2	-172.8	162.8	0	0	115	D288 A289 A330	E286-D288 PolarHBondContact O-N 2.77Å; E286-D288 VanDerWaalsContact O-N 3.09Å; E286-A289 WeakPolarHBondContact O-CB 3.5Å; E286-A289 PolarHBondContact O-N 3.11Å; E286-A330 PolarHBondContact N-O 3.36Å; E286-A330 VanDerWaalsContact N-O 3.12Å
287	I	89.3	Confident	79.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.4	-178.7	-166.4	167.4	0	0	0	113.4	I284 D285 A289 I290 G291 L312 M329 A330 L337 L341	I284-I287 HydrophobicContact CG2-CB 4.18Å; I284-I287 HydrophobicContact CG2-CD1 4.35Å; I284-I287 HydrophobicContact CG2-CG1 4.32Å; D285-I287 PolarHBondContact O-N 3.35Å; I287-A289 PolarHBondContact O-N 3.48Å; I287-I290 HydrophobicContact CG1-CD1 4.18Å; I287-I290 HydrophobicContact CG1-CG1 4.05Å; I287-I290 VanDerWaalsContact O-CG1 3.31Å; I287-I290 WeakPolarHBondContact O-CG1 3.47Å; I287-I290 PolarHBondContact O-N 3.25Å; I287-G291 PolarHBondContact O-N 3.31Å; I287-L312 HydrophobicContact CD1-CD2 4.23Å; I287-M329 HydrophobicContact CD1-CB 4.45Å; I287-M329 HydrophobicContact CD1-CG 3.86Å; I287-M329 HydrophobicContact CD1-SD 3.42Å; I287-M329 WeakPolarHBondContact CD1-SD 3.49Å; I287-M329 HydrophobicContact CG2-CB 4.48Å; I287-A330 PolarHBondContact N-O 3.32Å; I287-A330 VanDerWaalsContact N-O 3.11Å; I287-L337 HydrophobicContact CG2-CD1 4.06Å; I287-L337 HydrophobicContact CG2-CD2 4.04Å; I287-L341 HydrophobicContact CD1-CD1 4.46Å; I287-L341 HydrophobicContact CD1-CD2 4.41Å
288	D	87.8	Confident	78.6	Confident	29 Å²	29	51.6 Å²	51.6	16%	0.155	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-20.8	172.6	47.4	-46.6	0	0	0	113.5	E286 I290 T292 T331 L337	E286-D288 PolarHBondContact O-N 2.77Å; E286-D288 VanDerWaalsContact O-N 3.09Å; D288-I290 VanDerWaalsContact C-N 3.3Å; D288-I290 PolarHBondContact O-N 3.45Å; D288-T292 WeakPolarHBondContact O-CG2 3.44Å; D288-T331 PolarHBondContact OD1-OG1 3.47Å; D288-L337 HydrophobicContact CB-CD2 4.21Å
289	A	84.3	Confident	78.4	Confident	34 Å²	34	52.5 Å²	52.5	28%	0.281	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-39.6	173.6	0	0	0	0	0	112.7	E286 I287 R294	E286-A289 WeakPolarHBondContact O-CB 3.5Å; E286-A289 PolarHBondContact O-N 3.11Å; I287-A289 PolarHBondContact O-N 3.48Å; A289-R294 PolarHBondContact O-NH2 3.3Å
290	I	82.9	Confident	78.1	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-100.6	-26.9	179.5	56	163.9	0	0	0	113.2	G252 L255 I256 I287 D288 I305 L312	G252-I290 WeakPolarHBondContact O-CG2 2.96Å; L255-I290 HydrophobicContact CD1-CD1 3.83Å; I256-I290 HydrophobicContact CD1-CG2 3.82Å; I256-I290 HydrophobicContact CG1-CG2 3.58Å; I287-I290 HydrophobicContact CG1-CD1 4.18Å; I287-I290 HydrophobicContact CG1-CG1 4.05Å; I287-I290 VanDerWaalsContact O-CG1 3.31Å; I287-I290 WeakPolarHBondContact O-CG1 3.47Å; I287-I290 PolarHBondContact O-N 3.25Å; D288-I290 VanDerWaalsContact C-N 3.3Å; D288-I290 PolarHBondContact O-N 3.45Å; I290-I305 HydrophobicContact CB-CG2 4.41Å; I290-I305 HydrophobicContact CG2-CG2 4.47Å; I290-L312 HydrophobicContact CD1-CD2 3.82Å
291	G	71.7	Confident	77.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-89.1	2.3	-170.4	0	0	0	0	0	115.4	I287 K293 L337 D338	I287-G291 PolarHBondContact O-N 3.31Å; G291-K293 PolarHBondContact O-N 2.97Å; G291-L337 CarbonylContact O-C 3.52Å; G291-L337 VanDerWaalsContact O-CA 3.31Å; G291-L337 WeakPolarHBondContact O-CA 3.44Å; G291-D338 PolarHBondContact O-N 2.94Å; G291-D338 VanDerWaalsContact O-N 3.15Å
292	T	72.2	Confident	77.5	Confident	52 Å²	52	57.1 Å²	57.1	32%	0.319	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-58.9	133.3	178.3	35.5	0	0	0	0	111.3	D288 R294 T336	D288-T292 WeakPolarHBondContact O-CG2 3.44Å; T292-R294 PolarHBondContact O-N 2.83Å; T292-R294 PolarHBondContact OG1-NE 3.44Å; T292-T336 WeakPolarHBondContact CA-O 3.48Å
293	K	63.1	Low	77.2	Confident	94 Å²	94	64.2 Å²	64.2	41%	0.409	34%	0.339	S	S	.	.			trans	-59	94.6	169.8	-71.5	168	-176.6	154.9	0	110.2	G291 Y295 E335 T336 L337	G291-K293 PolarHBondContact O-N 2.97Å; K293-Y295 HydrophobicContact CB-CE2 4.07Å; K293-E335 PolarHBondContact NZ-O 3.4Å; K293-T336 PolarHBondContact N-O 2.86Å; K293-L337 VanDerWaalsContact CE-O 3.3Å; K293-L337 WeakPolarHBondContact CE-O 3.43Å
294	R	65.8	Low	76.9	Confident	90 Å²	90	65.2 Å²	65.2	34%	0.34	34%	0.344	S	S	.	.			trans	-96.3	99.1	172.8	-63.1	-178.3	-163.3	-165.4	7.8	108	A289 T292 E296	A289-R294 PolarHBondContact O-NH2 3.3Å; T292-R294 PolarHBondContact O-N 2.83Å; T292-R294 PolarHBondContact OG1-NE 3.44Å; R294-E296 PolarHBondContact O-N 3Å
295	Y	59.7	Low	76.6	Confident	191 Å²	191	66.2 Å²	66.2	75%	0.749	35%	0.348	S	S	*	.			trans	-73.9	107.3	174	-69.2	-79.1	0	0	0	108.9	K293 S297	K293-Y295 HydrophobicContact CB-CE2 4.07Å; Y295-S297 VanDerWaalsContact C-N 3.31Å; Y295-S297 PolarHBondContact O-N 3.11Å
296	E	58.1	Low	76.3	Confident	189 Å²	189	70.4 Å²	70.4	88%	0.883	37%	0.368	S	S	*	.			trans	35.1	47.9	161.3	-62.3	-172.6	167.3	0	0	117.3	R294 N298	R294-E296 PolarHBondContact O-N 3Å; E296-N298 PolarHBondContact O-N 2.57Å
297	S	59.5	Low	76.1	Confident	47 Å²	47	73.1 Å²	73.1	33%	0.329	37%	0.374	S	S	.	.			trans	-72.2	133.2	165.1	-39.9	0	0	0	0	109	Y295 S299 E302	Y295-S297 VanDerWaalsContact C-N 3.31Å; Y295-S297 PolarHBondContact O-N 3.11Å; S297-S299 PolarHBondContact O-N 2.9Å; S297-E302 WeakPolarHBondContact CB-OE1 3.36Å; S297-E302 WeakPolarHBondContact CB-OE2 3.45Å; S297-E302 VanDerWaalsContact OG-CD 3.29Å; S297-E302 PolarHBondContact OG-OE1 2.68Å; S297-E302 PolarHBondContact OG-OE2 2.93Å
298	N	67	Low	76.1	Confident	143 Å²	143	73.3 Å²	73.3	77%	0.765	38%	0.375	S	S	*	.			trans	-71.2	6.5	179	-85.5	-27	0	0	0	114.6	E296 G300 R303	E296-N298 PolarHBondContact O-N 2.57Å; N298-G300 PolarHBondContact O-N 3.19Å; N298-R303 PolarHBondContact OD1-NH2 2.86Å
299	S	77.1	Confident	76	Confident	66 Å²	66	72.4 Å²	72.4	46%	0.462	37%	0.37	S	S	.	.			trans	-75.3	122.4	178.8	-64.3	0	0	0	0	111	S297 G301 E302	S297-S299 PolarHBondContact O-N 2.9Å; S299-G301 PolarHBondContact O-N 3.25Å; S299-G301 VanDerWaalsContact O-N 3.13Å; S299-E302 PolarHBondContact O-N 3.14Å
300	G	78.2	Confident	76.2	Confident	56 Å²	56	75.4 Å²	75.4	58%	0.577	38%	0.381	S	S	*	.	H	α-helix	trans	-55.3	-32.1	-180	0	0	0	0	0	114.2	N298 E302 R303 E304	N298-G300 PolarHBondContact O-N 3.19Å; G300-E302 VanDerWaalsContact C-N 3.34Å; G300-E302 PolarHBondContact O-N 2.98Å; G300-R303 PolarHBondContact O-N 2.97Å; G300-E304 PolarHBondContact O-N 3.16Å
301	G	79.3	Confident	76.4	Confident	53 Å²	53	76.2 Å²	76.2	55%	0.546	39%	0.385	S	S	.	.	H	α-helix	trans	-67.1	-29.7	177.4	0	0	0	0	0	114.3	S299 I305	S299-G301 PolarHBondContact O-N 3.25Å; S299-G301 VanDerWaalsContact O-N 3.13Å; G301-I305 WeakPolarHBondContact O-CG1 3.48Å; G301-I305 PolarHBondContact O-N 3.48Å
302	E	80	Confident	77.2	Confident	49 Å²	49	76.3 Å²	76.3	23%	0.229	39%	0.385	C	S	.	.	H	α-helix	trans	-76.2	-36.4	178	-67.6	-178.8	-135.1	0	0	111.9	S297 S299 G300 E304 I305 Q306	S297-E302 WeakPolarHBondContact CB-OE1 3.36Å; S297-E302 WeakPolarHBondContact CB-OE2 3.45Å; S297-E302 VanDerWaalsContact OG-CD 3.29Å; S297-E302 PolarHBondContact OG-OE1 2.68Å; S297-E302 PolarHBondContact OG-OE2 2.93Å; S299-E302 PolarHBondContact O-N 3.14Å; G300-E302 VanDerWaalsContact C-N 3.34Å; G300-E302 PolarHBondContact O-N 2.98Å; E302-E304 PolarHBondContact O-N 3.13Å; E302-I305 PolarHBondContact O-N 3.49Å; E302-Q306 PolarHBondContact O-N 2.99Å
303	R	82.7	Confident	77.9	Confident	148 Å²	148	74.1 Å²	74.1	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-60.5	-36.8	173.9	-65.2	-176	-179.5	179.2	0.5	111.7	N298 G300 Q306 R307	N298-R303 PolarHBondContact OD1-NH2 2.86Å; G300-R303 PolarHBondContact O-N 2.97Å; R303-Q306 PolarHBondContact O-N 2.89Å; R303-R307 WeakPolarHBondContact O-CB 3.23Å; R303-R307 PolarHBondContact O-N 3.43Å
304	E	83.9	Confident	79	Confident	22 Å²	22	73.9 Å²	73.9	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-66.5	-44.1	176.9	-173.5	58.5	-161.9	0	0	111.8	G261 G300 E302 Q306 R307 T308	G261-E304 PolarHBondContact N-OE1 3.34Å; G300-E304 PolarHBondContact O-N 3.16Å; E302-E304 PolarHBondContact O-N 3.13Å; E304-Q306 VanDerWaalsContact C-N 3.32Å; E304-Q306 PolarHBondContact O-N 2.82Å; E304-R307 WeakPolarHBondContact O-CB 3.38Å; E304-R307 PolarHBondContact O-N 2.69Å; E304-R307 VanDerWaalsContact O-N 3.12Å; E304-T308 PolarHBondContact O-N 3.2Å; E304-T308 PolarHBondContact O-OG1 2.91Å
305	I	85.1	Confident	79.9	Confident	20 Å²	20	71.8 Å²	71.8	10%	0.103	37%	0.369	C	S	.	.	H	α-helix	trans	-62	-42.2	176.7	-66.4	165.1	0	0	0	110.8	I256 I290 G301 E302 R307 T308 M309	I256-I305 HydrophobicContact CD1-CD1 4.2Å; I256-I305 HydrophobicContact CD1-CG1 4.43Å; I256-I305 HydrophobicContact CG1-CG1 4.31Å; I256-I305 HydrophobicContact CG2-CD1 4.1Å; I256-I305 HydrophobicContact CG2-CG1 4.05Å; I290-I305 HydrophobicContact CB-CG2 4.41Å; I290-I305 HydrophobicContact CG2-CG2 4.47Å; G301-I305 WeakPolarHBondContact O-CG1 3.48Å; G301-I305 PolarHBondContact O-N 3.48Å; E302-I305 PolarHBondContact O-N 3.49Å; I305-R307 VanDerWaalsContact C-N 3.32Å; I305-R307 PolarHBondContact O-N 2.87Å; I305-T308 PolarHBondContact O-N 3.4Å; I305-M309 PolarHBondContact O-N 3.48Å
306	Q	84.7	Confident	81	Confident	101 Å²	101	63 Å²	63	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-39.8	174.9	-170.8	-178.4	8.1	0	0	111.8	E302 R303 E304 M309 L310	E302-Q306 PolarHBondContact O-N 2.99Å; R303-Q306 PolarHBondContact O-N 2.89Å; E304-Q306 VanDerWaalsContact C-N 3.32Å; E304-Q306 PolarHBondContact O-N 2.82Å; Q306-M309 HydrophobicContact CG-CE 4.43Å; Q306-M309 PolarHBondContact O-N 2.93Å; Q306-L310 HydrophobicContact CG-CD1 4.48Å; Q306-L310 WeakPolarHBondContact O-CG 3.32Å; Q306-L310 PolarHBondContact O-N 2.81Å
307	R	86.6	Confident	81.8	Confident	147 Å²	147	56.8 Å²	56.8	56%	0.555	31%	0.308	S	S	*	.	H	α-helix	trans	-64.1	-43.2	176.5	-170.4	-178.9	-179.6	-176.9	0	111.9	P264 R303 E304 I305 M309 L310 E311	P264-R307 HydrophobicContact CG-CG 4.03Å; R303-R307 WeakPolarHBondContact O-CB 3.23Å; R303-R307 PolarHBondContact O-N 3.43Å; E304-R307 WeakPolarHBondContact O-CB 3.38Å; E304-R307 PolarHBondContact O-N 2.69Å; E304-R307 VanDerWaalsContact O-N 3.12Å; I305-R307 VanDerWaalsContact C-N 3.32Å; I305-R307 PolarHBondContact O-N 2.87Å; R307-M309 VanDerWaalsContact C-N 3.33Å; R307-M309 PolarHBondContact O-N 3.48Å; R307-L310 PolarHBondContact O-N 3.37Å; R307-E311 PolarHBondContact O-N 3.11Å
308	T	88.2	Confident	82	Confident	4 Å²	4	55 Å²	55	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-42.4	173.7	-55.7	0	0	0	0	111.6	L255 P264 V267 E304 I305 E311 L312	L255-T308 HydrophobicContact CB-CG2 4.28Å; P264-T308 WeakPolarHBondContact CD-OG1 3.29Å; V267-T308 HydrophobicContact CG2-CG2 3.84Å; E304-T308 PolarHBondContact O-N 3.2Å; E304-T308 PolarHBondContact O-OG1 2.91Å; I305-T308 PolarHBondContact O-N 3.4Å; T308-E311 PolarHBondContact O-N 2.87Å; T308-L312 PolarHBondContact O-N 3.42Å
309	M	86.9	Confident	81.1	Confident	11 Å²	11	57.7 Å²	57.7	5%	0.054	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-43.3	176.9	-176	-172.7	70.6	0	0	112.1	I305 Q306 R307 E311 L312 L313 D338 L341	I305-M309 PolarHBondContact O-N 3.48Å; Q306-M309 HydrophobicContact CG-CE 4.43Å; Q306-M309 PolarHBondContact O-N 2.93Å; R307-M309 VanDerWaalsContact C-N 3.33Å; R307-M309 PolarHBondContact O-N 3.48Å; M309-E311 VanDerWaalsContact C-N 3.33Å; M309-E311 PolarHBondContact O-N 3.15Å; M309-L312 WeakPolarHBondContact O-CB 3.47Å; M309-L312 PolarHBondContact O-N 2.84Å; M309-L313 WeakPolarHBondContact O-CG 3.39Å; M309-L313 PolarHBondContact O-N 2.79Å; M309-D338 HydrophobicContact CE-CB 4.19Å; M309-D338 WeakPolarHBondContact CE-OD2 3.35Å; M309-D338 HydrophobicContact SD-CB 4.02Å; M309-L341 HydrophobicContact SD-CD1 4.49Å
310	L	87	Confident	80	Confident	96 Å²	96	60.9 Å²	60.9	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-37.7	176.6	-71.9	172.3	0	0	0	112.3	Q306 R307 L313 N314	Q306-L310 HydrophobicContact CG-CD1 4.48Å; Q306-L310 WeakPolarHBondContact O-CG 3.32Å; Q306-L310 PolarHBondContact O-N 2.81Å; R307-L310 PolarHBondContact O-N 3.37Å; L310-L313 HydrophobicContact CD2-CD1 4.39Å; L310-L313 WeakPolarHBondContact O-CB 3.05Å; L310-L313 PolarHBondContact O-N 3.41Å; L310-N314 PolarHBondContact O-N 2.97Å
311	E	88.2	Confident	79.1	Confident	22 Å²	22	62 Å²	62	10%	0.103	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-44.5	173.3	-176	66	-149.5	0	0	111	P264 V267 R268 R307 T308 M309 L313 N314 Q315	P264-E311 HydrophobicContact CB-CB 4.03Å; P264-E311 HydrophobicContact CB-CG 4.01Å; V267-E311 HydrophobicContact CB-CG 4.39Å; V267-E311 HydrophobicContact CG1-CG 4.26Å; R268-E311 HydrophobicContact CG-CG 4.25Å; R268-E311 VanDerWaalsContact CG-OE1 3.27Å; R268-E311 WeakPolarHBondContact CG-OE1 3.13Å; R268-E311 IonicContact CZ-OE1 3.11Å; R268-E311 IonicContact CZ-OE2 3.9Å; R268-E311 IonicContact NE-OE1 3.08Å; R268-E311 PolarHBondContact NE-OE1 3.12Å; R268-E311 IonicContact NE-OE2 3.25Å; R268-E311 PolarHBondContact NE-OE2 3.47Å; R268-E311 IonicContact NH2-OE1 2.77Å; R268-E311 IonicContact NH2-OE2 3.85Å; R268-E311 PolarHBondContact NH2-OE2 2.98Å; R307-E311 PolarHBondContact O-N 3.11Å; T308-E311 PolarHBondContact O-N 2.87Å; M309-E311 VanDerWaalsContact C-N 3.33Å; M309-E311 PolarHBondContact O-N 3.15Å; E311-L313 VanDerWaalsContact C-N 3.28Å; E311-L313 PolarHBondContact O-N 2.8Å; E311-N314 WeakPolarHBondContact O-CB 3.49Å; E311-N314 PolarHBondContact O-N 3Å; E311-N314 VanDerWaalsContact O-N 3.12Å; E311-Q315 HydrophobicContact CG-CG 4.41Å; E311-Q315 WeakPolarHBondContact O-CB 3.04Å; E311-Q315 WeakPolarHBondContact O-CG 3.23Å; E311-Q315 PolarHBondContact O-N 3.28Å; E311-Q315 PolarHBondContact OE1-NE2 2.8Å
312	L	88.6	Confident	78.2	Confident	1 Å²	1	63 Å²	63	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-56.6	-43.9	173.6	177.9	61.6	0	0	0	111.1	V267 F271 I284 I287 I290 T308 M309 N314 Q315 L316	V267-L312 HydrophobicContact CG1-CB 4.12Å; V267-L312 HydrophobicContact CG1-CD1 4.13Å; F271-L312 HydrophobicContact CE2-CD1 3.66Å; F271-L312 HydrophobicContact CZ-CD1 4.09Å; I284-L312 HydrophobicContact CD1-CD1 3.97Å; I284-L312 HydrophobicContact CD1-CD2 4.25Å; I287-L312 HydrophobicContact CD1-CD2 4.23Å; I290-L312 HydrophobicContact CD1-CD2 3.82Å; T308-L312 PolarHBondContact O-N 3.42Å; M309-L312 WeakPolarHBondContact O-CB 3.47Å; M309-L312 PolarHBondContact O-N 2.84Å; L312-N314 PolarHBondContact O-N 2.81Å; L312-Q315 CarbonylContact O-C 3.58Å; L312-Q315 PolarHBondContact O-N 3.26Å; L312-L316 HydrophobicContact CD1-CD1 4.42Å; L312-L316 HydrophobicContact CD1-CG 4.34Å; L312-L316 HydrophobicContact CG-CD1 4.19Å; L312-L316 VanDerWaalsContact O-CG 3.24Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 2.53Å
313	L	85.7	Confident	77.5	Confident	6 Å²	6	62.2 Å²	62.2	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-43.9	174.9	-76.4	177.2	0	0	0	113.1	M309 L310 E311 Q315 L316 D317 A340 L341	M309-L313 WeakPolarHBondContact O-CG 3.39Å; M309-L313 PolarHBondContact O-N 2.79Å; L310-L313 HydrophobicContact CD2-CD1 4.39Å; L310-L313 WeakPolarHBondContact O-CB 3.05Å; L310-L313 PolarHBondContact O-N 3.41Å; E311-L313 VanDerWaalsContact C-N 3.28Å; E311-L313 PolarHBondContact O-N 2.8Å; L313-Q315 VanDerWaalsContact C-N 3.33Å; L313-L316 PolarHBondContact O-N 2.93Å; L313-L316 VanDerWaalsContact O-N 3.11Å; L313-D317 PolarHBondContact O-N 2.91Å; L313-A340 HydrophobicContact CD1-CB 3.91Å; L313-L341 HydrophobicContact CD2-CB 4.17Å; L313-L341 HydrophobicContact CD2-CD2 3.19Å; L313-L341 HydrophobicContact CD2-CG 3.55Å; L313-L341 HydrophobicContact CG-CD2 3.95Å; L313-L341 HydrophobicContact CG-CG 4.25Å
314	N	86.5	Confident	77.3	Confident	90 Å²	90	59.8 Å²	59.8	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-42.4	175.8	-166.9	23.7	0	0	0	110.9	L310 E311 L312 L316 D317 G318	L310-N314 PolarHBondContact O-N 2.97Å; E311-N314 WeakPolarHBondContact O-CB 3.49Å; E311-N314 PolarHBondContact O-N 3Å; E311-N314 VanDerWaalsContact O-N 3.12Å; L312-N314 PolarHBondContact O-N 2.81Å; N314-L316 PolarHBondContact O-N 3.4Å; N314-D317 PolarHBondContact O-N 2.96Å; N314-G318 WeakPolarHBondContact O-CA 3.45Å; N314-G318 PolarHBondContact O-N 2.77Å
315	Q	85.3	Confident	77.4	Confident	45 Å²	45	60 Å²	60	21%	0.21	31%	0.306	C	S	.	.	H	α-helix	trans	-74.1	-1.4	173.3	-61.8	-58.8	-23.3	0	0	114.2	V267 F271 E311 L312 L313 R322	V267-Q315 HydrophobicContact CG1-CB 4.31Å; V267-Q315 HydrophobicContact CG1-CG 4.07Å; F271-Q315 HydrophobicContact CD2-CB 3.5Å; F271-Q315 HydrophobicContact CD2-CG 4.11Å; F271-Q315 WeakPolarHBondContact CE1-O 3.46Å; F271-Q315 HydrophobicContact CE2-CB 3.67Å; F271-Q315 HydrophobicContact CG-CB 4.01Å; F271-Q315 HydrophobicContact CZ-CB 4.3Å; E311-Q315 HydrophobicContact CG-CG 4.41Å; E311-Q315 WeakPolarHBondContact O-CB 3.04Å; E311-Q315 WeakPolarHBondContact O-CG 3.23Å; E311-Q315 PolarHBondContact O-N 3.28Å; E311-Q315 PolarHBondContact OE1-NE2 2.8Å; L312-Q315 CarbonylContact O-C 3.58Å; L312-Q315 PolarHBondContact O-N 3.26Å; L313-Q315 VanDerWaalsContact C-N 3.33Å; Q315-R322 PolarHBondContact O-NH1 3.1Å; Q315-R322 PolarHBondContact O-NH2 2.82Å
316	L	82	Confident	77.4	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-100.7	-35	168.9	-72	173.9	0	0	0	112.3	F271 L312 L313 N314 R322 V327 M329 L341	F271-L316 HydrophobicContact CE1-CD2 4.33Å; F271-L316 HydrophobicContact CZ-CD2 3.82Å; F271-L316 HydrophobicContact CZ-CG 4.44Å; L312-L316 HydrophobicContact CD1-CD1 4.42Å; L312-L316 HydrophobicContact CD1-CG 4.34Å; L312-L316 HydrophobicContact CG-CD1 4.19Å; L312-L316 VanDerWaalsContact O-CG 3.24Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 2.53Å; L313-L316 PolarHBondContact O-N 2.93Å; L313-L316 VanDerWaalsContact O-N 3.11Å; N314-L316 PolarHBondContact O-N 3.4Å; L316-R322 VanDerWaalsContact CA-NH1 3.25Å; L316-R322 PolarHBondContact O-NH1 2.81Å; L316-V327 HydrophobicContact CD2-CB 4.09Å; L316-V327 HydrophobicContact CD2-CG1 3.84Å; L316-V327 HydrophobicContact CD2-CG2 3.72Å; L316-M329 HydrophobicContact CD1-CE 4.28Å; L316-M329 HydrophobicContact CD1-SD 4.27Å; L316-L341 HydrophobicContact CD1-CD2 4.12Å
317	D	75.8	Confident	77.7	Confident	59 Å²	59	55.3 Å²	55.3	32%	0.316	28%	0.284	S	S	.	.	H	α-helix	trans	-79.4	-33.1	177.2	-145.9	-10.1	0	0	0	112.2	L313 N314 R346	L313-D317 PolarHBondContact O-N 2.91Å; N314-D317 PolarHBondContact O-N 2.96Å; D317-R346 HydrophobicContact CB-CG 4.37Å; D317-R346 IonicContact OD2-CZ 2.75Å; D317-R346 IonicContact OD2-NE 3.5Å; D317-R346 PolarHBondContact OD2-NE 3.47Å; D317-R346 VanDerWaalsContact OD2-NE 3.11Å; D317-R346 IonicContact OD2-NH2 3.32Å; D317-R346 PolarHBondContact OD2-NH2 3.44Å
318	G	63	Low	77.8	Confident	10 Å²	10	48.3 Å²	48.3	10%	0.103	26%	0.258	C	S	.	.			trans	-32.8	128.1	-157.9	0	0	0	0	0	116.5	N314 D320 R322	N314-G318 WeakPolarHBondContact O-CA 3.45Å; N314-G318 PolarHBondContact O-N 2.77Å; G318-D320 PolarHBondContact O-N 3.36Å; G318-D320 VanDerWaalsContact O-N 3.1Å; G318-R322 VanDerWaalsContact N-CZ 3.35Å; G318-R322 PolarHBondContact O-NE 2.89Å
319	F	49.1	Very low	78	Confident	199 Å²	199	48.2 Å²	48.2	87%	0.873	26%	0.257	S	S	*	.			trans	-64.5	-5.8	-173.6	-81.9	-99.6	0	0	0	115.7
320	D	53.9	Low	78.3	Confident	133 Å²	133	47.8 Å²	47.8	71%	0.711	26%	0.256	S	S	*	.	S	Bend	trans	-73.7	153	176.1	-68.2	-47.9	0	0	0	110.8	G318 R322	G318-D320 PolarHBondContact O-N 3.36Å; G318-D320 VanDerWaalsContact O-N 3.1Å; D320-R322 PolarHBondContact O-N 3.24Å
321	S	58.1	Low	78.5	Confident	80 Å²	80	43.3 Å²	43.3	56%	0.559	23%	0.232	S	C	*	.			trans	-66.6	72.4	171	52.4	0	0	0	0	108.8	R37 G323	R37-S321 PolarHBondContact NH2-OG 2.66Å; S321-G323 PolarHBondContact O-N 2.91Å
322	R	60	Low	78.6	Confident	73 Å²	73	45 Å²	45	28%	0.275	24%	0.242	S	C	.	.			trans	-49.1	125.9	173.2	-68.4	165.1	-177.1	-102.7	-37.1	106.1	Q315 L316 G318 D320	Q315-R322 PolarHBondContact O-NH1 3.1Å; Q315-R322 PolarHBondContact O-NH2 2.82Å; L316-R322 VanDerWaalsContact CA-NH1 3.25Å; L316-R322 PolarHBondContact O-NH1 2.81Å; G318-R322 VanDerWaalsContact N-CZ 3.35Å; G318-R322 PolarHBondContact O-NE 2.89Å; D320-R322 PolarHBondContact O-N 3.24Å
323	G	65.5	Low	78.5	Confident	33 Å²	33	52.1 Å²	52.1	34%	0.34	27%	0.269	S	S	.	.			trans	-58.5	-160.1	168.9	0	0	0	0	0	111.5	S321 V325	S321-G323 PolarHBondContact O-N 2.91Å; G323-V325 PolarHBondContact O-N 3.49Å
324	D	79.3	Confident	78.6	Confident	96 Å²	96	53.7 Å²	53.7	51%	0.513	28%	0.277	S	S	.	.	S	Bend	trans	-80.2	58.6	-179.9	-62.5	-45.5	0	0	0	111.1	L205 S278 P279 S280	L205-D324 HydrophobicContact CD2-CB 4.47Å; S278-D324 PolarHBondContact OG-N 2.81Å; P279-D324 WeakPolarHBondContact CA-O 3.47Å; P279-D324 HydrophobicContact CB-CB 3.94Å; S280-D324 PolarHBondContact N-O 3.01Å
325	V	85.6	Confident	78.7	Confident	26 Å²	26	55 Å²	55	16%	0.158	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.3	176.5	-173	0	0	0	0	109.3	A274 S280 V282 G323	A274-V325 HydrophobicContact CB-CG1 3.99Å; A274-V325 HydrophobicContact CB-CG2 4.43Å; S280-V325 WeakPolarHBondContact O-CA 3.2Å; V282-V325 HydrophobicContact CG2-CG1 3.94Å; G323-V325 PolarHBondContact O-N 3.49Å
326	K	86.3	Confident	78.7	Confident	14 Å²	14	54.6 Å²	54.6	6%	0.061	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	141.3	176.5	-56.9	-57	-175.6	-179.2	0	110.4	V201 P219 S280 I281 V282	V201-K326 HydrophobicContact CG1-CB 4Å; V201-K326 HydrophobicContact CG1-CG 4.12Å; P219-K326 PolarHBondContact O-NZ 3.04Å; S280-K326 PolarHBondContact O-N 3.47Å; I281-K326 CarbonylContact C-O 3.58Å; I281-K326 WeakPolarHBondContact CA-O 3.16Å; I281-K326 HydrophobicContact CG1-CB 4.39Å; V282-K326 PolarHBondContact N-O 3.25Å
327	V	89.2	Confident	78.8	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.055	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.2	180	-174.1	0	0	0	0	110.7	K220 G221 V222 F271 V282 I284 L316 M329	K220-V327 PolarHBondContact O-N 2.88Å; G221-V327 WeakPolarHBondContact CA-O 3.43Å; V222-V327 PolarHBondContact N-O 2.88Å; F271-V327 HydrophobicContact CE1-CG2 4.14Å; F271-V327 HydrophobicContact CZ-CG2 4.48Å; V282-V327 HydrophobicContact CB-CG2 4.49Å; V282-V327 WeakPolarHBondContact O-CA 3.25Å; I284-V327 HydrophobicContact CD1-CG1 4.46Å; L316-V327 HydrophobicContact CD2-CB 4.09Å; L316-V327 HydrophobicContact CD2-CG1 3.84Å; L316-V327 HydrophobicContact CD2-CG2 3.72Å; V327-M329 HydrophobicContact CG1-CE 4.14Å; V327-M329 HydrophobicContact CG1-CG 4.16Å
328	I	90.3	Very high	79.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.1	173.6	-57.5	176	0	0	0	107.8	V222 L224 V239 I281 V282 F283 I284	V222-I328 WeakPolarHBondContact O-CA 3.27Å; L224-I328 HydrophobicContact CD1-CG2 3.91Å; L224-I328 HydrophobicContact CG-CG2 4.11Å; V239-I328 HydrophobicContact CG1-CD1 4.41Å; I281-I328 HydrophobicContact CG2-CD1 3.8Å; I281-I328 HydrophobicContact CG2-CG1 4.16Å; V282-I328 PolarHBondContact O-N 3.31Å; F283-I328 CarbonylContact C-O 3.32Å; F283-I328 WeakPolarHBondContact CA-O 3.35Å; F283-I328 HydrophobicContact CD2-CB 3.9Å; F283-I328 HydrophobicContact CD2-CG2 3.68Å; F283-I328 WeakPolarHBondContact CD2-O 3.32Å; F283-I328 HydrophobicContact CE2-CG2 3.97Å; I284-I328 PolarHBondContact N-O 2.93Å
329	M	91.8	Very high	80.1	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133.7	177.7	-73.2	171.2	-85.3	0	0	109.9	V222 I223 L224 I284 I287 L316 V327 I347	V222-M329 PolarHBondContact O-N 2.86Å; I223-M329 CarbonylContact C-O 3.58Å; I223-M329 WeakPolarHBondContact CA-O 3.38Å; I223-M329 HydrophobicContact CG1-CB 4.2Å; L224-M329 PolarHBondContact N-O 3.09Å; I284-M329 HydrophobicContact CB-CG 4.22Å; I284-M329 HydrophobicContact CD1-CG 4.47Å; I284-M329 CarbonylContact O-C 3.53Å; I284-M329 WeakPolarHBondContact O-CA 3.37Å; I287-M329 HydrophobicContact CD1-CB 4.45Å; I287-M329 HydrophobicContact CD1-CG 3.86Å; I287-M329 HydrophobicContact CD1-SD 3.42Å; I287-M329 WeakPolarHBondContact CD1-SD 3.49Å; I287-M329 HydrophobicContact CG2-CB 4.48Å; L316-M329 HydrophobicContact CD1-CE 4.28Å; L316-M329 HydrophobicContact CD1-SD 4.27Å; V327-M329 HydrophobicContact CG1-CE 4.14Å; V327-M329 HydrophobicContact CG1-CG 4.16Å; M329-I347 HydrophobicContact CE-CD1 3.26Å; M329-I347 HydrophobicContact CE-CG1 3.4Å; M329-I347 VanDerWaalsContact CE-CG1 3.4Å; M329-I347 HydrophobicContact SD-CD1 4.09Å
330	A	92.6	Very high	81.7	Confident	3 Å²	3	48.9 Å²	48.9	3%	0.025	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.6	172.1	0	0	0	0	0	110.7	L224 K232 F283 I284 E286 I287	L224-A330 HydrophobicContact CB-CB 4.49Å; L224-A330 WeakPolarHBondContact O-CA 3.41Å; K232-A330 HydrophobicContact CB-CB 4.41Å; F283-A330 HydrophobicContact CE2-CB 3.93Å; F283-A330 HydrophobicContact CZ-CB 3.93Å; I284-A330 PolarHBondContact O-N 3.05Å; E286-A330 PolarHBondContact N-O 3.36Å; E286-A330 VanDerWaalsContact N-O 3.12Å; I287-A330 PolarHBondContact N-O 3.32Å; I287-A330 VanDerWaalsContact N-O 3.11Å
331	T	91.9	Very high	83	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.8	176.8	-176.5	0	0	0	0	111.2	I223 L224 Y225 K232 D288 R333 I334 L337	I223-T331 HydrophobicContact CD1-CG2 4.02Å; I223-T331 HydrophobicContact CG1-CG2 4.19Å; L224-T331 PolarHBondContact O-N 2.98Å; Y225-T331 WeakPolarHBondContact CA-O 3.39Å; K232-T331 PolarHBondContact NZ-O 3.48Å; D288-T331 PolarHBondContact OD1-OG1 3.47Å; T331-R333 PolarHBondContact OG1-N 2.98Å; T331-I334 HydrophobicContact CG2-CB 4.23Å; T331-L337 HydrophobicContact CG2-CD1 3.77Å
332	N	90.7	Very high	84.2	Confident	58 Å²	58	40.7 Å²	40.7	31%	0.31	22%	0.215	S	C	.	.	S	Bend	trans	-86.8	-19.1	171.2	-66.1	-35.1	0	0	0	113.3	G226 K232	G226-N332 VanDerWaalsContact O-O 3.06Å; K232-N332 PolarHBondContact NZ-OD1 2.76Å
333	R	85.9	Confident	85.3	Confident	151 Å²	151	45.6 Å²	45.6	57%	0.57	23%	0.233	S	C	*	.			trans	-140.7	82.5	-170.9	-67.2	-174.9	-174.3	177.2	1.3	111.2	T331 E335 T336	T331-R333 PolarHBondContact OG1-N 2.98Å; R333-E335 VanDerWaalsContact CB-OE1 3.3Å; R333-E335 WeakPolarHBondContact CB-OE1 3.49Å; R333-E335 PolarHBondContact O-N 3.25Å; R333-T336 HydrophobicContact CB-CG2 3.94Å; R333-T336 WeakPolarHBondContact CB-OG1 3.13Å; R333-T336 PolarHBondContact O-N 2.99Å; R333-T336 PolarHBondContact O-OG1 2.97Å
334	I	88.3	Confident	86.1	Confident	38 Å²	38	49.2 Å²	49.2	20%	0.195	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63.9	-28.8	-177	-168.4	165.2	0	0	0	112.8	Y225 T331 T336 L337	Y225-I334 HydrophobicContact CD1-CD1 3.65Å; Y225-I334 HydrophobicContact CD2-CB 4.03Å; Y225-I334 HydrophobicContact CD2-CD1 3.99Å; Y225-I334 HydrophobicContact CD2-CG2 3.65Å; Y225-I334 HydrophobicContact CE1-CD1 3.99Å; Y225-I334 HydrophobicContact CE2-CD1 4.27Å; Y225-I334 HydrophobicContact CE2-CG2 4.11Å; Y225-I334 HydrophobicContact CG-CB 4.07Å; Y225-I334 HydrophobicContact CG-CD1 3.64Å; Y225-I334 HydrophobicContact CG-CG1 4.43Å; Y225-I334 HydrophobicContact CG-CG2 4.21Å; T331-I334 HydrophobicContact CG2-CB 4.23Å; I334-T336 VanDerWaalsContact C-N 3.28Å; I334-T336 PolarHBondContact O-N 2.97Å; I334-L337 WeakPolarHBondContact O-CB 3.39Å; I334-L337 PolarHBondContact O-N 3.2Å
335	E	88.2	Confident	86	Confident	119 Å²	119	46.3 Å²	46.3	56%	0.556	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-67	-27.7	179.5	67.2	-73	170.5	0	0	113.4	K293 R333	K293-E335 PolarHBondContact NZ-O 3.4Å; R333-E335 VanDerWaalsContact CB-OE1 3.3Å; R333-E335 WeakPolarHBondContact CB-OE1 3.49Å; R333-E335 PolarHBondContact O-N 3.25Å
336	T	85.6	Confident	85.8	Confident	36 Å²	36	47.4 Å²	47.4	22%	0.221	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-82	-18.4	179.2	66.3	0	0	0	0	112.9	T292 K293 R333 I334	T292-T336 WeakPolarHBondContact CA-O 3.48Å; K293-T336 PolarHBondContact N-O 2.86Å; R333-T336 HydrophobicContact CB-CG2 3.94Å; R333-T336 WeakPolarHBondContact CB-OG1 3.13Å; R333-T336 PolarHBondContact O-N 2.99Å; R333-T336 PolarHBondContact O-OG1 2.97Å; I334-T336 VanDerWaalsContact C-N 3.28Å; I334-T336 PolarHBondContact O-N 2.97Å
337	L	84.2	Confident	85.7	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-69.9	148.7	-178.9	-65.4	-179	0	0	0	112.3	I223 I287 D288 G291 K293 T331 I334 P339	I223-L337 HydrophobicContact CD1-CD1 3.74Å; I287-L337 HydrophobicContact CG2-CD1 4.06Å; I287-L337 HydrophobicContact CG2-CD2 4.04Å; D288-L337 HydrophobicContact CB-CD2 4.21Å; G291-L337 CarbonylContact O-C 3.52Å; G291-L337 VanDerWaalsContact O-CA 3.31Å; G291-L337 WeakPolarHBondContact O-CA 3.44Å; K293-L337 VanDerWaalsContact CE-O 3.3Å; K293-L337 WeakPolarHBondContact CE-O 3.43Å; T331-L337 HydrophobicContact CG2-CD1 3.77Å; I334-L337 WeakPolarHBondContact O-CB 3.39Å; I334-L337 PolarHBondContact O-N 3.2Å; L337-P339 WeakPolarHBondContact O-CD 3.47Å
338	D	82.9	Confident	85.5	Confident	44 Å²	44	49.8 Å²	49.8	24%	0.235	26%	0.258	C	S	.	.			trans	-58.3	124.2	171.4	-170.3	-20.8	0	0	0	110.7	G291 M309 A340 L341	G291-D338 PolarHBondContact O-N 2.94Å; G291-D338 VanDerWaalsContact O-N 3.15Å; M309-D338 HydrophobicContact CE-CB 4.19Å; M309-D338 WeakPolarHBondContact CE-OD2 3.35Å; M309-D338 HydrophobicContact SD-CB 4.02Å; D338-A340 PolarHBondContact O-N 3.27Å; D338-A340 VanDerWaalsContact OD1-CB 3.3Å; D338-A340 WeakPolarHBondContact OD1-CB 3.41Å; D338-A340 PolarHBondContact OD1-N 3.03Å; D338-L341 HydrophobicContact CB-CD1 4.35Å; D338-L341 WeakPolarHBondContact O-CB 2.84Å; D338-L341 PolarHBondContact O-N 3.29Å
339	P	83.3	Confident	85.4	Confident	74 Å²	74	55.5 Å²	55.5	48%	0.481	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-25.8	172.2	-28.3	36.8	0	0	0	114.3	L337 L341 I342	L337-P339 WeakPolarHBondContact O-CD 3.47Å; P339-L341 VanDerWaalsContact C-N 3.3Å; P339-L341 PolarHBondContact O-N 3.5Å; P339-I342 VanDerWaalsContact O-CG1 3.23Å; P339-I342 WeakPolarHBondContact O-CG1 3.43Å; P339-I342 PolarHBondContact O-N 2.84Å
340	A	82.3	Confident	85.3	Confident	33 Å²	33	59.6 Å²	59.6	27%	0.273	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.8	177	0	0	0	0	0	113.5	L313 D338 R346	L313-A340 HydrophobicContact CD1-CB 3.91Å; D338-A340 PolarHBondContact O-N 3.27Å; D338-A340 VanDerWaalsContact OD1-CB 3.3Å; D338-A340 WeakPolarHBondContact OD1-CB 3.41Å; D338-A340 PolarHBondContact OD1-N 3.03Å; A340-R346 PolarHBondContact O-NH1 3.07Å
341	L	81.3	Confident	85.2	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-42.8	174.7	-78.4	161.5	0	0	0	111.3	I287 M309 L313 L316 D338 P339 R343 I347	I287-L341 HydrophobicContact CD1-CD1 4.46Å; I287-L341 HydrophobicContact CD1-CD2 4.41Å; M309-L341 HydrophobicContact SD-CD1 4.49Å; L313-L341 HydrophobicContact CD2-CB 4.17Å; L313-L341 HydrophobicContact CD2-CD2 3.19Å; L313-L341 HydrophobicContact CD2-CG 3.55Å; L313-L341 HydrophobicContact CG-CD2 3.95Å; L313-L341 HydrophobicContact CG-CG 4.25Å; L316-L341 HydrophobicContact CD1-CD2 4.12Å; D338-L341 HydrophobicContact CB-CD1 4.35Å; D338-L341 WeakPolarHBondContact O-CB 2.84Å; D338-L341 PolarHBondContact O-N 3.29Å; P339-L341 VanDerWaalsContact C-N 3.3Å; P339-L341 PolarHBondContact O-N 3.5Å; L341-R343 VanDerWaalsContact C-N 3.27Å; L341-R343 PolarHBondContact O-N 3.04Å; L341-I347 WeakPolarHBondContact O-CD1 3.36Å; L341-I347 WeakPolarHBondContact O-CG1 3.49Å
342	I	82.8	Confident	85.2	Confident	40 Å²	40	64.9 Å²	64.9	21%	0.205	32%	0.322	C	S	.	.	S	Bend	trans	-85.6	8.7	-170.7	62.2	167.9	0	0	0	114.6	I223 P339 K350	I223-I342 HydrophobicContact CD1-CG2 4.39Å; P339-I342 VanDerWaalsContact O-CG1 3.23Å; P339-I342 WeakPolarHBondContact O-CG1 3.43Å; P339-I342 PolarHBondContact O-N 2.84Å; I342-K350 VanDerWaalsContact O-CE 3.31Å; I342-K350 WeakPolarHBondContact O-CE 3.17Å; I342-K350 PolarHBondContact O-NZ 2.92Å
343	R	84.4	Confident	85.2	Confident	175 Å²	175	62.2 Å²	62.2	66%	0.66	31%	0.307	S	S	*	.	S	Bend	trans	-71.5	133.9	-179.1	-169.5	177	-179.9	-178.8	-0.1	110.5	L341 G345 R346 I347	L341-R343 VanDerWaalsContact C-N 3.27Å; L341-R343 PolarHBondContact O-N 3.04Å; R343-G345 PolarHBondContact O-N 2.78Å; R343-R346 PolarHBondContact O-N 2.81Å; R343-I347 PolarHBondContact O-N 2.86Å
344	P	80.9	Confident	85.3	Confident	109 Å²	109	58 Å²	58	71%	0.708	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	136.6	173.3	-25.2	33.9	0	0	0	111.6
345	G	77.5	Confident	85.1	Confident	36 Å²	36	59.7 Å²	59.7	37%	0.371	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	-27.4	-172	0	0	0	0	0	114.2	R343	R343-G345 PolarHBondContact O-N 2.78Å
346	R	82.3	Confident	85	Confident	49 Å²	49	55.1 Å²	55.1	19%	0.185	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-49.6	169.5	-62.4	174.9	-176.9	-179.9	-10.6	110.5	D317 A340 R343	D317-R346 HydrophobicContact CB-CG 4.37Å; D317-R346 IonicContact OD2-CZ 2.75Å; D317-R346 IonicContact OD2-NE 3.5Å; D317-R346 PolarHBondContact OD2-NE 3.47Å; D317-R346 VanDerWaalsContact OD2-NE 3.11Å; D317-R346 IonicContact OD2-NH2 3.32Å; D317-R346 PolarHBondContact OD2-NH2 3.44Å; A340-R346 PolarHBondContact O-NH1 3.07Å; R343-R346 PolarHBondContact O-N 2.81Å
347	I	83.8	Confident	85	Confident	3 Å²	3	59 Å²	59	2%	0.015	31%	0.309	C	S	.	.			trans	-121	113.5	176.4	-56.5	180	0	0	0	107.7	I223 M329 L341 R343 R349 K350	I223-I347 HydrophobicContact CB-CD1 4.21Å; I223-I347 HydrophobicContact CB-CG2 3.91Å; I223-I347 HydrophobicContact CD1-CD1 4.23Å; I223-I347 HydrophobicContact CG2-CG2 3.67Å; M329-I347 HydrophobicContact CE-CD1 3.26Å; M329-I347 HydrophobicContact CE-CG1 3.4Å; M329-I347 VanDerWaalsContact CE-CG1 3.4Å; M329-I347 HydrophobicContact SD-CD1 4.09Å; L341-I347 WeakPolarHBondContact O-CD1 3.36Å; L341-I347 WeakPolarHBondContact O-CG1 3.49Å; R343-I347 PolarHBondContact O-N 2.86Å; I347-R349 WeakPolarHBondContact CG2-O 3.35Å; I347-K350 HydrophobicContact CG2-CG 4.46Å
348	D	85.1	Confident	85	Confident	70 Å²	70	63.2 Å²	63.2	37%	0.374	33%	0.328	S	S	.	.			trans	-94.5	-29.1	-176.3	-59.8	-58.7	0	0	0	111.9	P219 K220 G221	P219-D348 WeakPolarHBondContact CA-OD2 3.43Å; P219-D348 HydrophobicContact CB-CB 3.85Å; K220-D348 PolarHBondContact N-OD2 2.93Å; G221-D348 PolarHBondContact O-N 3.2Å
349	R	87.4	Confident	85.2	Confident	121 Å²	121	63 Å²	63	46%	0.457	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131	-178.6	-60.2	-64.5	-176.8	176.7	-1.8	111.1	P219 G221 V222 I223 I347	P219-R349 HydrophobicContact CB-CG 4.44Å; G221-R349 PolarHBondContact O-N 2.96Å; V222-R349 WeakPolarHBondContact CA-O 3.37Å; V222-R349 HydrophobicContact CB-CB 4.44Å; V222-R349 HydrophobicContact CG1-CB 4.12Å; V222-R349 HydrophobicContact CG2-CB 4.03Å; V222-R349 HydrophobicContact CG2-CG 4.47Å; I223-R349 PolarHBondContact N-O 3.31Å; I347-R349 WeakPolarHBondContact CG2-O 3.35Å
350	K	90	Very high	85.4	Confident	87 Å²	87	60.4 Å²	60.4	38%	0.378	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	104.2	176.1	-54	-177.3	-179.3	178.9	0	107.8	I223 Y225 I342 I347	I223-K350 HydrophobicContact CG2-CB 3.85Å; I223-K350 HydrophobicContact CG2-CG 3.67Å; Y225-K350 HydrophobicContact CE1-CB 3.9Å; I342-K350 VanDerWaalsContact O-CE 3.31Å; I342-K350 WeakPolarHBondContact O-CE 3.17Å; I342-K350 PolarHBondContact O-NZ 2.92Å; I347-K350 HydrophobicContact CG2-CG 4.46Å
351	I	90.7	Very high	85.6	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	115.8	-175.6	-52.3	-176	0	0	0	108.4	Q194 E197 I198 V222 I223 L224 Y225 F353	Q194-I351 HydrophobicContact CB-CG2 3.67Å; Q194-I351 HydrophobicContact CG-CG2 3.49Å; Q194-I351 VanDerWaalsContact CG-CG2 3.49Å; E197-I351 HydrophobicContact CB-CD1 3.8Å; E197-I351 HydrophobicContact CB-CG1 4.28Å; I198-I351 HydrophobicContact CB-CD1 4.19Å; I198-I351 HydrophobicContact CG1-CD1 4.46Å; V222-I351 HydrophobicContact CG1-CD1 3.57Å; V222-I351 HydrophobicContact CG1-CG1 3.87Å; I223-I351 PolarHBondContact O-N 3.1Å; L224-I351 HydrophobicContact CD2-CB 3.9Å; L224-I351 HydrophobicContact CD2-CD1 3.85Å; L224-I351 HydrophobicContact CD2-CG1 4.2Å; L224-I351 HydrophobicContact CD2-CG2 4.46Å; Y225-I351 WeakPolarHBondContact CD1-O 3.49Å; Y225-I351 PolarHBondContact N-O 2.99Å; I351-F353 HydrophobicContact CB-CE2 4.27Å; I351-F353 HydrophobicContact CG2-CD2 4.37Å; I351-F353 HydrophobicContact CG2-CE2 3.8Å; I351-F353 HydrophobicContact CG2-CZ 4.35Å
352	E	91.3	Very high	85.9	Confident	112 Å²	112	64.4 Å²	64.4	52%	0.523	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	133.7	175.2	-168.3	174.3	-178.9	0	0	110.9	Q194 Y225 P354	Q194-E352 WeakPolarHBondContact CG-O 3.28Å; Q194-E352 PolarHBondContact NE2-O 3.31Å; Y225-E352 HydrophobicContact CD2-CG 4.33Å; Y225-E352 HydrophobicContact CE1-CB 4.02Å; Y225-E352 HydrophobicContact CE2-CB 3.91Å; Y225-E352 HydrophobicContact CE2-CG 3.68Å; Y225-E352 CarbonylContact O-C 3.58Å; E352-P354 VanDerWaalsContact O-CD 3.26Å; E352-P354 WeakPolarHBondContact O-CD 3.3Å
353	F	90.1	Very high	86.2	Confident	3 Å²	3	66.9 Å²	66.9	1%	0.013	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	94.4	173.5	-71.9	-105.4	0	0	0	108.8	L191 L224 Y225 T230 K232 L235 I351	L191-F353 HydrophobicContact CD1-CD1 3.84Å; L191-F353 HydrophobicContact CD1-CE1 4.03Å; L224-F353 HydrophobicContact CB-CD2 4.35Å; L224-F353 HydrophobicContact CB-CE2 3.65Å; L224-F353 HydrophobicContact CB-CZ 4.37Å; L224-F353 HydrophobicContact CD1-CE2 4.44Å; L224-F353 HydrophobicContact CD1-CZ 4.37Å; L224-F353 HydrophobicContact CD2-CE2 3.79Å; L224-F353 HydrophobicContact CD2-CZ 4.15Å; L224-F353 HydrophobicContact CG-CE2 4.13Å; Y225-F353 WeakPolarHBondContact O-CD2 3.29Å; Y225-F353 PolarHBondContact O-N 3.36Å; T230-F353 WeakPolarHBondContact OG1-CB 3.32Å; K232-F353 HydrophobicContact CG-CB 4.39Å; K232-F353 HydrophobicContact CG-CD1 4.18Å; K232-F353 HydrophobicContact CG-CD2 3.81Å; K232-F353 HydrophobicContact CG-CE1 4.41Å; K232-F353 HydrophobicContact CG-CE2 4.09Å; K232-F353 HydrophobicContact CG-CG 3.86Å; K232-F353 HydrophobicContact CG-CZ 4.36Å; L235-F353 HydrophobicContact CB-CE1 4.41Å; L235-F353 HydrophobicContact CB-CZ 4.37Å; L235-F353 HydrophobicContact CD2-CE1 4.01Å; L235-F353 HydrophobicContact CD2-CZ 3.54Å; I351-F353 HydrophobicContact CB-CE2 4.27Å; I351-F353 HydrophobicContact CG2-CD2 4.37Å; I351-F353 HydrophobicContact CG2-CE2 3.8Å; I351-F353 HydrophobicContact CG2-CZ 4.35Å
354	P	88.1	Confident	86.5	Confident	61 Å²	61	59.4 Å²	59.4	40%	0.396	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-67.3	167.8	173.1	30.5	-35.1	0	0	0	110.6	E352	E352-P354 VanDerWaalsContact O-CD 3.26Å; E352-P354 WeakPolarHBondContact O-CD 3.3Å
355	L	85.9	Confident	86.8	Confident	74 Å²	74	54.3 Å²	54.3	39%	0.387	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-61.8	146.1	165.4	-68.6	171.6	0	0	0	109.4	A227 D357 D389	A227-L355 HydrophobicContact CB-CD2 4.03Å; L355-D357 PolarHBondContact O-N 3.33Å; L355-D389 HydrophobicContact CD1-CB 4.48Å
356	P	85.3	Confident	87.4	Confident	23 Å²	23	58 Å²	58	15%	0.149	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-69.5	132.8	-174.2	28.8	-35.1	0	0	0	111.8	T360 I361 I364 L390	P356-T360 HydrophobicContact CB-CG2 3.78Å; P356-I361 HydrophobicContact CB-CG1 3.84Å; P356-I361 HydrophobicContact CG-CD1 4.32Å; P356-I361 HydrophobicContact CG-CG1 3.79Å; P356-I361 WeakPolarHBondContact O-CD1 3.39Å; P356-I364 HydrophobicContact CB-CD1 4.06Å; P356-I364 HydrophobicContact CG-CD1 4.5Å; P356-L390 WeakPolarHBondContact CD-O 3.37Å; P356-L390 WeakPolarHBondContact CG-O 3.43Å
357	D	85.8	Confident	87.7	Confident	118 Å²	118	57.5 Å²	57.5	63%	0.631	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-65.1	160.6	172.1	-60.7	-41.4	0	0	0	112.1	L355 G359 T360 I361	L355-D357 PolarHBondContact O-N 3.33Å; D357-G359 PolarHBondContact O-N 3.23Å; D357-G359 VanDerWaalsContact O-N 3.14Å; D357-T360 CarbonylContact O-C 3.54Å; D357-T360 WeakPolarHBondContact O-CA 3.27Å; D357-T360 WeakPolarHBondContact O-CB 3.17Å; D357-T360 PolarHBondContact O-N 3.2Å; D357-I361 WeakPolarHBondContact O-CG1 3.16Å; D357-I361 PolarHBondContact O-N 3.38Å
358	E	84.8	Confident	87.9	Confident	91 Å²	91	60.1 Å²	60.1	43%	0.425	30%	0.297	S	S	.	.	H	α-helix	trans	-48.6	-44.5	176.2	-69.1	179.1	-171	0	0	112.8	T360 I361 R362 V384 K387	E358-T360 VanDerWaalsContact C-N 3.33Å; E358-T360 PolarHBondContact O-N 2.67Å; E358-I361 PolarHBondContact O-N 3.25Å; E358-R362 PolarHBondContact O-N 2.96Å; E358-R362 VanDerWaalsContact O-N 3.1Å; E358-V384 HydrophobicContact CB-CG1 3.6Å; E358-V384 HydrophobicContact CG-CG1 4.07Å; E358-V384 WeakPolarHBondContact O-CG1 3.23Å; E358-K387 WeakPolarHBondContact OE1-CE 3.24Å
359	G	85.6	Confident	88.1	Confident	39 Å²	39	57.1 Å²	57.1	40%	0.402	28%	0.281	S	S	.	.	H	α-helix	trans	-66.1	-33.6	176.2	0	0	0	0	0	113.7	D357 K363	D357-G359 PolarHBondContact O-N 3.23Å; D357-G359 VanDerWaalsContact O-N 3.14Å; G359-K363 PolarHBondContact O-N 2.97Å
360	T	87.1	Confident	88.1	Confident	20 Å²	20	56.8 Å²	56.8	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-74.2	-42.4	176.9	-61.4	0	0	0	0	110.8	G189 P356 D357 E358 R362 K363 I364	G189-T360 WeakPolarHBondContact O-CG2 3.02Å; P356-T360 HydrophobicContact CB-CG2 3.78Å; D357-T360 CarbonylContact O-C 3.54Å; D357-T360 WeakPolarHBondContact O-CA 3.27Å; D357-T360 WeakPolarHBondContact O-CB 3.17Å; D357-T360 PolarHBondContact O-N 3.2Å; E358-T360 VanDerWaalsContact C-N 3.33Å; E358-T360 PolarHBondContact O-N 2.67Å; T360-R362 VanDerWaalsContact C-N 3.3Å; T360-R362 PolarHBondContact O-N 2.92Å; T360-K363 WeakPolarHBondContact O-CB 3.43Å; T360-K363 PolarHBondContact O-N 3.32Å; T360-K363 VanDerWaalsContact O-N 3.11Å; T360-I364 HydrophobicContact CG2-CD1 3.98Å; T360-I364 HydrophobicContact CG2-CG1 4.44Å; T360-I364 WeakPolarHBondContact O-CG1 3.3Å; T360-I364 PolarHBondContact O-N 2.85Å
361	I	87.3	Confident	87.9	Confident	13 Å²	13	63.5 Å²	63.5	7%	0.067	31%	0.312	C	S	.	.	H	α-helix	trans	-56.3	-45.5	174.5	-66.2	172.9	0	0	0	110.3	P356 D357 E358 K363 I364 F365 V384 V395	P356-I361 HydrophobicContact CB-CG1 3.84Å; P356-I361 HydrophobicContact CG-CD1 4.32Å; P356-I361 HydrophobicContact CG-CG1 3.79Å; P356-I361 WeakPolarHBondContact O-CD1 3.39Å; D357-I361 WeakPolarHBondContact O-CG1 3.16Å; D357-I361 PolarHBondContact O-N 3.38Å; E358-I361 PolarHBondContact O-N 3.25Å; I361-K363 VanDerWaalsContact C-N 3.33Å; I361-K363 PolarHBondContact O-N 2.83Å; I361-I364 PolarHBondContact O-N 3.28Å; I361-I364 VanDerWaalsContact O-N 3.11Å; I361-F365 HydrophobicContact CG2-CD2 3.7Å; I361-F365 HydrophobicContact CG2-CE2 3.62Å; I361-F365 WeakPolarHBondContact O-CD2 3.06Å; I361-F365 PolarHBondContact O-N 2.84Å; I361-V384 HydrophobicContact CG2-CG2 4.03Å; I361-V395 HydrophobicContact CG2-CG2 4.19Å
362	R	87.9	Confident	87.7	Confident	106 Å²	106	66.3 Å²	66.3	40%	0.4	33%	0.325	S	S	.	.	H	α-helix	trans	-57	-45	176.2	-170.1	-176.7	-69	119.1	-1.9	112	E358 T360 I364 F365 Q366 D381 V384	E358-R362 PolarHBondContact O-N 2.96Å; E358-R362 VanDerWaalsContact O-N 3.1Å; T360-R362 VanDerWaalsContact C-N 3.3Å; T360-R362 PolarHBondContact O-N 2.92Å; R362-I364 PolarHBondContact O-N 3.24Å; R362-F365 PolarHBondContact O-N 3.15Å; R362-Q366 PolarHBondContact O-N 2.95Å; R362-D381 IonicContact CZ-OD1 2.86Å; R362-D381 IonicContact NE-OD1 3.82Å; R362-D381 PolarHBondContact NE-OD1 3.01Å; R362-D381 IonicContact NH2-OD1 3.74Å; R362-D381 PolarHBondContact NH2-OD1 3.23Å; R362-D381 IonicContact NH2-OD2 3.25Å; R362-V384 HydrophobicContact CB-CG2 4.18Å
363	K	88.9	Confident	87.7	Confident	92 Å²	92	65.1 Å²	65.1	40%	0.4	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-41.5	175.7	-69.4	178.8	179.7	179.1	0	111.7	D192 G359 T360 I361 Q366 I367	D192-K363 IonicContact OD2-NZ 2.89Å; G359-K363 PolarHBondContact O-N 2.97Å; T360-K363 WeakPolarHBondContact O-CB 3.43Å; T360-K363 PolarHBondContact O-N 3.32Å; T360-K363 VanDerWaalsContact O-N 3.11Å; I361-K363 VanDerWaalsContact C-N 3.33Å; I361-K363 PolarHBondContact O-N 2.83Å; K363-Q366 PolarHBondContact O-N 3.03Å; K363-I367 WeakPolarHBondContact O-CG1 3.28Å; K363-I367 PolarHBondContact O-N 2.98Å
364	I	90	Very high	87.6	Confident	19 Å²	19	67.5 Å²	67.5	10%	0.097	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-44	178.9	-64.8	166.6	0	0	0	110.9	P356 T360 I361 R362 Q366 I367 H368 V395	P356-I364 HydrophobicContact CB-CD1 4.06Å; P356-I364 HydrophobicContact CG-CD1 4.5Å; T360-I364 HydrophobicContact CG2-CD1 3.98Å; T360-I364 HydrophobicContact CG2-CG1 4.44Å; T360-I364 WeakPolarHBondContact O-CG1 3.3Å; T360-I364 PolarHBondContact O-N 2.85Å; I361-I364 PolarHBondContact O-N 3.28Å; I361-I364 VanDerWaalsContact O-N 3.11Å; R362-I364 PolarHBondContact O-N 3.24Å; I364-Q366 PolarHBondContact O-N 2.8Å; I364-I367 PolarHBondContact O-N 3.43Å; I364-H368 PolarHBondContact O-CD2 2.75Å; I364-H368 PolarHBondContact O-N 3.2Å; I364-H368 VanDerWaalsContact O-N 3.11Å; I364-V395 HydrophobicContact CB-CG1 4.37Å; I364-V395 HydrophobicContact CG2-CB 3.91Å; I364-V395 HydrophobicContact CG2-CG1 3.66Å; I364-V395 HydrophobicContact CG2-CG2 4.49Å
365	F	88.9	Confident	87.6	Confident	1 Å²	1	65.4 Å²	65.4	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-56.2	-51.9	173.3	-90	-72.4	0	0	0	110.6	I361 R362 I367 H368 T369 F380 F383 V395 I398	I361-F365 HydrophobicContact CG2-CD2 3.7Å; I361-F365 HydrophobicContact CG2-CE2 3.62Å; I361-F365 WeakPolarHBondContact O-CD2 3.06Å; I361-F365 PolarHBondContact O-N 2.84Å; R362-F365 PolarHBondContact O-N 3.15Å; F365-I367 VanDerWaalsContact C-N 3.33Å; F365-I367 PolarHBondContact O-N 3.42Å; F365-H368 PolarHBondContact O-N 2.83Å; F365-T369 WeakPolarHBondContact O-CB 3.44Å; F365-T369 VanDerWaalsContact O-CG2 3.29Å; F365-T369 WeakPolarHBondContact O-CG2 3.4Å; F365-T369 PolarHBondContact O-N 3.24Å; F365-T369 PolarHBondContact O-OG1 3.13Å; F365-F380 HydrophobicContact CB-CD1 4.07Å; F365-F380 HydrophobicContact CB-CE1 4.39Å; F365-F380 HydrophobicContact CB-CG 4.4Å; F365-F380 HydrophobicContact CD1-CD1 4.09Å; F365-F380 HydrophobicContact CD1-CE1 4.26Å; F365-F380 HydrophobicContact CG-CD1 4.15Å; F365-F383 HydrophobicContact CE2-CB 4.37Å; F365-F383 HydrophobicContact CZ-CB 4.25Å; F365-V395 HydrophobicContact CB-CG1 4.48Å; F365-V395 HydrophobicContact CD1-CG1 3.72Å; F365-V395 HydrophobicContact CD2-CG1 3.73Å; F365-V395 HydrophobicContact CE1-CG1 3.75Å; F365-V395 HydrophobicContact CE2-CG1 3.76Å; F365-V395 HydrophobicContact CE2-CG2 4.05Å; F365-V395 HydrophobicContact CG-CG1 3.71Å; F365-V395 HydrophobicContact CZ-CB 4.49Å; F365-V395 HydrophobicContact CZ-CG1 3.76Å; F365-V395 HydrophobicContact CZ-CG2 4.34Å; F365-I398 HydrophobicContact CE1-CG2 4.3Å
366	Q	88.9	Confident	87.6	Confident	114 Å²	114	69.8 Å²	69.8	53%	0.533	35%	0.35	S	S	.	.	H	α-helix	trans	-54.9	-46.9	-179.9	-171.3	178.3	6.2	0	0	112.1	R362 K363 I364 H368 T369 N370	R362-Q366 PolarHBondContact O-N 2.95Å; K363-Q366 PolarHBondContact O-N 3.03Å; I364-Q366 PolarHBondContact O-N 2.8Å; Q366-H368 PolarHBondContact O-N 3.39Å; Q366-T369 PolarHBondContact O-N 3.36Å; Q366-T369 PolarHBondContact O-OG1 2.97Å; Q366-N370 PolarHBondContact O-N 3.3Å; Q366-N370 PolarHBondContact O-ND2 2.95Å; Q366-N370 PolarHBondContact O-OD1 2.84Å
367	I	89.8	Confident	87.6	Confident	38 Å²	38	72.6 Å²	72.6	20%	0.195	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-46.2	179.7	-68.6	165.9	0	0	0	111.4	K363 I364 F365	K363-I367 WeakPolarHBondContact O-CG1 3.28Å; K363-I367 PolarHBondContact O-N 2.98Å; I364-I367 PolarHBondContact O-N 3.43Å; F365-I367 VanDerWaalsContact C-N 3.33Å; F365-I367 PolarHBondContact O-N 3.42Å
368	H	88.1	Confident	87.5	Confident	58 Å²	58	68 Å²	68	27%	0.269	34%	0.34	S	S	.	.	H	α-helix	trans	-71.8	-29.6	-179.2	-72.4	-43.7	0	0	0	113.2	I364 F365 Q366 C399	I364-H368 PolarHBondContact O-CD2 2.75Å; I364-H368 PolarHBondContact O-N 3.2Å; I364-H368 VanDerWaalsContact O-N 3.11Å; F365-H368 PolarHBondContact O-N 2.83Å; Q366-H368 PolarHBondContact O-N 3.39Å; H368-C399 HydrophobicContact CB-CB 4.3Å
369	T	87.7	Confident	87.5	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.043	34%	0.342	C	S	.	.	H	α-helix	trans	-86.7	-12.9	179.5	60.4	0	0	0	0	113.6	F365 Q366 R371 M372 L374 F380 F419	F365-T369 WeakPolarHBondContact O-CB 3.44Å; F365-T369 VanDerWaalsContact O-CG2 3.29Å; F365-T369 WeakPolarHBondContact O-CG2 3.4Å; F365-T369 PolarHBondContact O-N 3.24Å; F365-T369 PolarHBondContact O-OG1 3.13Å; Q366-T369 PolarHBondContact O-N 3.36Å; Q366-T369 PolarHBondContact O-OG1 2.97Å; T369-R371 PolarHBondContact O-N 3.11Å; T369-M372 PolarHBondContact O-N 3.45Å; T369-L374 HydrophobicContact CG2-CD2 4.27Å; T369-F380 HydrophobicContact CG2-CE1 3.88Å; T369-F380 HydrophobicContact CG2-CZ 3.76Å; T369-F419 HydrophobicContact CG2-CZ 4.2Å
370	N	87	Confident	87.4	Confident	114 Å²	114	67.8 Å²	67.8	61%	0.61	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.7	179.6	-80.4	-21.8	0	0	0	114.1	Q366	Q366-N370 PolarHBondContact O-N 3.3Å; Q366-N370 PolarHBondContact O-ND2 2.95Å; Q366-N370 PolarHBondContact O-OD1 2.84Å
371	R	86.5	Confident	87.1	Confident	229 Å²	229	69.6 Å²	69.6	86%	0.864	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.2	177	-61.5	-175.2	-173.7	-179.4	3.1	113.4	T369	T369-R371 PolarHBondContact O-N 3.11Å
372	M	87.5	Confident	86.8	Confident	61 Å²	61	73.3 Å²	73.3	30%	0.3	36%	0.357	S	S	.	.	S	Bend	trans	-102.7	145.1	-177.1	-67.2	-177	157.9	0	0	111	T369 L374 C399	T369-M372 PolarHBondContact O-N 3.45Å; M372-L374 PolarHBondContact O-N 3.45Å; M372-C399 WeakPolarHBondContact CE-O 3.45Å; M372-C399 HydrophobicContact SD-CB 4.46Å
373	T	89.8	Confident	86.4	Confident	87 Å²	87	68.7 Å²	68.7	53%	0.534	34%	0.34	S	S	.	.			trans	-85.5	100.6	171.3	33.7	0	0	0	0	109.5	M412 K413 V414	T373-M412 WeakPolarHBondContact CB-O 3.31Å; T373-M412 PolarHBondContact OG1-O 2.91Å; T373-K413 WeakPolarHBondContact O-CA 3.5Å; T373-V414 PolarHBondContact O-N 3.32Å
374	L	88.8	Confident	86	Confident	52 Å²	52	64.5 Å²	64.5	27%	0.272	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-83.3	149.4	176.5	-56.3	170.8	0	0	0	110.3	T369 M372 F380 F419	T369-L374 HydrophobicContact CG2-CD2 4.27Å; M372-L374 PolarHBondContact O-N 3.45Å; L374-F380 HydrophobicContact CD1-CE2 4.1Å; L374-F380 HydrophobicContact CD1-CZ 3.6Å; L374-F419 HydrophobicContact CD2-CE2 3.91Å; L374-F419 HydrophobicContact CD2-CZ 4.05Å
375	A	88.7	Confident	85.4	Confident	18 Å²	18	70.3 Å²	70.3	15%	0.149	35%	0.35	C	S	.	.			trans	-84	157.7	163.6	0	0	0	0	0	110.3	D377 V378 K413 V414 T415	A375-D377 WeakPolarHBondContact CB-OD1 3.33Å; A375-D377 PolarHBondContact O-N 3.5Å; A375-D377 VanDerWaalsContact O-N 3.14Å; A375-V378 PolarHBondContact O-N 3.28Å; A375-K413 HydrophobicContact CB-CB 4.31Å; A375-V414 WeakPolarHBondContact CB-O 3.25Å; A375-V414 PolarHBondContact N-O 2.98Å; A375-T415 HydrophobicContact CB-CG2 4.24Å
376	D	85.4	Confident	84.7	Confident	166 Å²	166	71.8 Å²	71.8	89%	0.888	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-6.8	-174	-53.9	-45.3	0	0	0	112.9	V378	D376-V378 VanDerWaalsContact C-N 3.34Å
377	D	85.9	Confident	83.5	Confident	81 Å²	81	74 Å²	74	43%	0.433	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-8.2	177.3	67.6	-41.6	0	0	0	113.6	A375 D379 Q416	A375-D377 WeakPolarHBondContact CB-OD1 3.33Å; A375-D377 PolarHBondContact O-N 3.5Å; A375-D377 VanDerWaalsContact O-N 3.14Å; D377-D379 PolarHBondContact O-N 3.13Å; D377-Q416 PolarHBondContact OD2-N 3.35Å
378	V	83	Confident	82.5	Confident	23 Å²	23	74.4 Å²	74.4	14%	0.139	37%	0.373	C	S	.	.			trans	-81.6	114.4	-174.4	-179	0	0	0	0	110.9	A375 D376 F380 F419	A375-V378 PolarHBondContact O-N 3.28Å; D376-V378 VanDerWaalsContact C-N 3.34Å; V378-F380 HydrophobicContact CG1-CD1 4.27Å; V378-F380 HydrophobicContact CG1-CE1 3.82Å; V378-F380 HydrophobicContact CG1-CZ 4.07Å; V378-F419 HydrophobicContact CG1-CD2 4.01Å; V378-F419 HydrophobicContact CG1-CE2 3.84Å; V378-F419 HydrophobicContact CG2-CD2 4.31Å; V378-F419 HydrophobicContact CG2-CE2 4.24Å
379	D	85.1	Confident	82	Confident	85 Å²	85	77.6 Å²	77.6	46%	0.455	39%	0.392	S	S	.	.			trans	-112.3	116.5	171.2	-173.2	5.1	0	0	0	110.4	D377 D381 F383 Q416	D377-D379 PolarHBondContact O-N 3.13Å; D379-D381 VanDerWaalsContact C-N 3.29Å; D379-D381 WeakPolarHBondContact OD1-CB 3.15Å; D379-D381 PolarHBondContact OD1-N 3.34Å; D379-F383 WeakPolarHBondContact O-CD2 3.4Å; D379-Q416 PolarHBondContact O-NE2 2.87Å
380	F	82.2	Confident	81.7	Confident	39 Å²	39	78 Å²	78	17%	0.171	39%	0.394	C	S	.	.	H	α-helix	trans	-72.3	-23.2	178.2	-62.5	-58.3	0	0	0	112.7	F365 T369 L374 V378 E382 F383 V384 F419	F365-F380 HydrophobicContact CB-CD1 4.07Å; F365-F380 HydrophobicContact CB-CE1 4.39Å; F365-F380 HydrophobicContact CB-CG 4.4Å; F365-F380 HydrophobicContact CD1-CD1 4.09Å; F365-F380 HydrophobicContact CD1-CE1 4.26Å; F365-F380 HydrophobicContact CG-CD1 4.15Å; T369-F380 HydrophobicContact CG2-CE1 3.88Å; T369-F380 HydrophobicContact CG2-CZ 3.76Å; L374-F380 HydrophobicContact CD1-CE2 4.1Å; L374-F380 HydrophobicContact CD1-CZ 3.6Å; V378-F380 HydrophobicContact CG1-CD1 4.27Å; V378-F380 HydrophobicContact CG1-CE1 3.82Å; V378-F380 HydrophobicContact CG1-CZ 4.07Å; F380-E382 VanDerWaalsContact C-N 3.29Å; F380-E382 PolarHBondContact O-N 3.43Å; F380-F383 PolarHBondContact O-N 2.84Å; F380-F383 VanDerWaalsContact O-N 3.13Å; F380-V384 WeakPolarHBondContact O-CG2 3.47Å; F380-V384 PolarHBondContact O-N 2.64Å; F380-F419 HydrophobicContact CE1-CZ 4.36Å
381	D	82.5	Confident	81.6	Confident	59 Å²	59	73.1 Å²	73.1	32%	0.316	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-32.2	-176.6	-73.1	-22.3	0	0	0	111.7	R362 D379 F383 V384 M385	R362-D381 IonicContact CZ-OD1 2.86Å; R362-D381 IonicContact NE-OD1 3.82Å; R362-D381 PolarHBondContact NE-OD1 3.01Å; R362-D381 IonicContact NH2-OD1 3.74Å; R362-D381 PolarHBondContact NH2-OD1 3.23Å; R362-D381 IonicContact NH2-OD2 3.25Å; D379-D381 VanDerWaalsContact C-N 3.29Å; D379-D381 WeakPolarHBondContact OD1-CB 3.15Å; D379-D381 PolarHBondContact OD1-N 3.34Å; D381-F383 VanDerWaalsContact C-N 3.27Å; D381-F383 PolarHBondContact O-N 3.08Å; D381-V384 PolarHBondContact O-N 3.3Å; D381-M385 WeakPolarHBondContact O-CB 3.29Å; D381-M385 VanDerWaalsContact O-CG 3.29Å; D381-M385 WeakPolarHBondContact O-CG 3.4Å; D381-M385 PolarHBondContact O-N 3.16Å
382	E	80.5	Confident	81.6	Confident	90 Å²	90	63 Å²	63	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-36.5	173.7	-166.7	-176.6	-180	0	0	111.8	F380 Q416 K420	F380-E382 VanDerWaalsContact C-N 3.29Å; F380-E382 PolarHBondContact O-N 3.43Å; E382-Q416 PolarHBondContact OE2-NE2 3.32Å; E382-K420 VanDerWaalsContact OE1-CE 3.22Å; E382-K420 WeakPolarHBondContact OE1-CE 3.13Å; E382-K420 IonicContact OE1-NZ 3.01Å; E382-K420 PolarHBondContact OE1-NZ 2.93Å; E382-K420 VanDerWaalsContact OE2-CE 3.31Å; E382-K420 WeakPolarHBondContact OE2-CE 3.49Å; E382-K420 IonicContact OE2-NZ 3.7Å; E382-K420 PolarHBondContact OE2-NZ 2.92Å
383	F	78.3	Confident	81.6	Confident	9 Å²	9	62.3 Å²	62.3	4%	0.039	34%	0.34	C	S	.	.	H	α-helix	trans	-79.5	-35.4	178.9	-60.3	-70.8	0	0	0	112.6	F365 D379 F380 D381 F419 K420	F365-F383 HydrophobicContact CE2-CB 4.37Å; F365-F383 HydrophobicContact CZ-CB 4.25Å; D379-F383 WeakPolarHBondContact O-CD2 3.4Å; F380-F383 PolarHBondContact O-N 2.84Å; F380-F383 VanDerWaalsContact O-N 3.13Å; D381-F383 VanDerWaalsContact C-N 3.27Å; D381-F383 PolarHBondContact O-N 3.08Å; F383-F419 HydrophobicContact CE1-CB 3.87Å; F383-F419 HydrophobicContact CE2-CB 3.73Å; F383-F419 HydrophobicContact CE2-CG 4.24Å; F383-F419 HydrophobicContact CZ-CB 3.24Å; F383-F419 HydrophobicContact CZ-CG 4.21Å; F383-K420 HydrophobicContact CE1-CG 4.21Å; F383-K420 HydrophobicContact CZ-CG 4.27Å
384	V	80.6	Confident	81.6	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-70	-40.7	177.7	175.9	0	0	0	0	110.9	E358 I361 R362 F380 D381 A386	E358-V384 HydrophobicContact CB-CG1 3.6Å; E358-V384 HydrophobicContact CG-CG1 4.07Å; E358-V384 WeakPolarHBondContact O-CG1 3.23Å; I361-V384 HydrophobicContact CG2-CG2 4.03Å; R362-V384 HydrophobicContact CB-CG2 4.18Å; F380-V384 WeakPolarHBondContact O-CG2 3.47Å; F380-V384 PolarHBondContact O-N 2.64Å; D381-V384 PolarHBondContact O-N 3.3Å; V384-A386 PolarHBondContact O-N 2.81Å
385	M	77.8	Confident	81.6	Confident	140 Å²	140	57 Å²	57	69%	0.69	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.9	-178.7	-75.8	-168.9	170.4	0	0	114.4	D381 K387	D381-M385 WeakPolarHBondContact O-CB 3.29Å; D381-M385 VanDerWaalsContact O-CG 3.29Å; D381-M385 WeakPolarHBondContact O-CG 3.4Å; D381-M385 PolarHBondContact O-N 3.16Å; M385-K387 PolarHBondContact O-N 3.35Å
386	A	74	Confident	81.6	Confident	33 Å²	33	61.9 Å²	61.9	27%	0.273	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.3	-179.8	0	0	0	0	0	113.7	V384 D388	V384-A386 PolarHBondContact O-N 2.81Å; A386-D388 PolarHBondContact O-N 3.28Å
387	K	63.8	Low	81.9	Confident	160 Å²	160	55.4 Å²	55.4	70%	0.696	30%	0.296	S	S	*	.			trans	48.2	34.1	177.9	-70.1	-173.5	174.9	-174.8	0	113.7	E358 M385	E358-K387 WeakPolarHBondContact OE1-CE 3.24Å; M385-K387 PolarHBondContact O-N 3.35Å
388	D	69.5	Low	82.1	Confident	46 Å²	46	51.7 Å²	51.7	25%	0.246	28%	0.276	C	S	.	.			trans	-77.2	136.1	169.1	-70	-41.6	0	0	0	107.8	A386 L390 R423	A386-D388 PolarHBondContact O-N 3.28Å; D388-L390 HydrophobicContact CB-CD1 4.27Å; D388-L390 HydrophobicContact CB-CD2 4.31Å; D388-L390 HydrophobicContact CB-CG 3.9Å; D388-L390 PolarHBondContact O-N 2.64Å; D388-R423 IonicContact OD2-CZ 3.11Å; D388-R423 IonicContact OD2-NE 3.38Å; D388-R423 PolarHBondContact OD2-NE 3.08Å; D388-R423 IonicContact OD2-NH2 3.72Å; D388-R423 PolarHBondContact OD2-NH2 3.11Å
389	D	77.3	Confident	82.5	Confident	126 Å²	126	50.8 Å²	50.8	67%	0.674	27%	0.27	S	S	*	.			trans	-66.9	71.4	175.2	-70.1	-39.3	0	0	0	110.6	L355 K430	L355-D389 HydrophobicContact CD1-CB 4.48Å; D389-K430 PolarHBondContact O-NZ 3.5Å
390	L	81.6	Confident	82.8	Confident	16 Å²	16	50.3 Å²	50.3	8%	0.084	27%	0.271	C	S	.	.			trans	-87.8	131.4	-176.4	-65.9	171.4	0	0	0	110.7	P356 D388 D394 V395 I398	P356-L390 WeakPolarHBondContact CD-O 3.37Å; P356-L390 WeakPolarHBondContact CG-O 3.43Å; D388-L390 HydrophobicContact CB-CD1 4.27Å; D388-L390 HydrophobicContact CB-CD2 4.31Å; D388-L390 HydrophobicContact CB-CG 3.9Å; D388-L390 PolarHBondContact O-N 2.64Å; L390-D394 HydrophobicContact CB-CB 4.45Å; L390-D394 HydrophobicContact CD2-CB 3.99Å; L390-V395 HydrophobicContact CB-CG2 4.43Å; L390-I398 HydrophobicContact CD1-CD1 4.33Å; L390-I398 HydrophobicContact CD2-CD1 4.28Å
391	S	85.1	Confident	83.2	Confident	10 Å²	10	50.5 Å²	50.5	7%	0.07	27%	0.272	C	S	.	.			trans	-82.7	161.1	168.8	69.2	0	0	0	0	110.9	A393 D394 V395	S391-A393 PolarHBondContact O-N 3.31Å; S391-D394 WeakPolarHBondContact CB-OD2 3.47Å; S391-D394 PolarHBondContact N-OD2 3.29Å; S391-D394 WeakPolarHBondContact O-CB 3.42Å; S391-D394 PolarHBondContact O-N 2.87Å; S391-D394 PolarHBondContact OG-N 3.27Å; S391-D394 VanDerWaalsContact OG-N 3.17Å; S391-D394 PolarHBondContact OG-OD1 3.37Å; S391-D394 PolarHBondContact OG-OD2 2.91Å; S391-V395 PolarHBondContact O-N 3.16Å
392	G	86	Confident	83.6	Confident	16 Å²	16	47.7 Å²	47.7	17%	0.165	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-31.3	173.8	0	0	0	0	0	112.8	G229 K396	G229-G392 PolarHBondContact O-N 3.18Å; G392-K396 PolarHBondContact O-N 3.28Å; G392-K396 VanDerWaalsContact O-N 3.11Å
393	A	87.8	Confident	84.2	Confident	48 Å²	48	44.4 Å²	44.4	40%	0.397	25%	0.248	S	C	.	.	H	α-helix	trans	-66.3	-38.3	171.7	0	0	0	0	0	112.8	G229 S391 K396 A397	G229-A393 PolarHBondContact O-N 2.88Å; G229-A393 VanDerWaalsContact O-N 3.1Å; S391-A393 PolarHBondContact O-N 3.31Å; A393-K396 PolarHBondContact O-N 3.09Å; A393-A397 WeakPolarHBondContact O-CB 3.41Å; A393-A397 PolarHBondContact O-N 2.87Å
394	D	89.2	Confident	84.8	Confident	28 Å²	28	48.6 Å²	48.6	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-43.1	176.5	-60.5	-38.1	0	0	0	110.7	L390 S391 K396 A397 I398 K430	L390-D394 HydrophobicContact CB-CB 4.45Å; L390-D394 HydrophobicContact CD2-CB 3.99Å; S391-D394 WeakPolarHBondContact CB-OD2 3.47Å; S391-D394 PolarHBondContact N-OD2 3.29Å; S391-D394 WeakPolarHBondContact O-CB 3.42Å; S391-D394 PolarHBondContact O-N 2.87Å; S391-D394 PolarHBondContact OG-N 3.27Å; S391-D394 VanDerWaalsContact OG-N 3.17Å; S391-D394 PolarHBondContact OG-OD1 3.37Å; S391-D394 PolarHBondContact OG-OD2 2.91Å; D394-K396 VanDerWaalsContact C-N 3.34Å; D394-K396 PolarHBondContact O-N 3.06Å; D394-A397 WeakPolarHBondContact O-CB 3.43Å; D394-A397 PolarHBondContact O-N 2.94Å; D394-A397 VanDerWaalsContact O-N 3.13Å; D394-I398 VanDerWaalsContact O-CG1 3.3Å; D394-I398 WeakPolarHBondContact O-CG1 3.35Å; D394-I398 PolarHBondContact O-N 2.76Å; D394-K430 IonicContact OD2-NZ 3.47Å; D394-K430 PolarHBondContact OD2-NZ 3.34Å
395	V	88.8	Confident	85.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.8	-45.4	175.9	176.7	0	0	0	0	110.9	I361 I364 F365 L390 S391 A397 I398 C399	I361-V395 HydrophobicContact CG2-CG2 4.19Å; I364-V395 HydrophobicContact CB-CG1 4.37Å; I364-V395 HydrophobicContact CG2-CB 3.91Å; I364-V395 HydrophobicContact CG2-CG1 3.66Å; I364-V395 HydrophobicContact CG2-CG2 4.49Å; F365-V395 HydrophobicContact CB-CG1 4.48Å; F365-V395 HydrophobicContact CD1-CG1 3.72Å; F365-V395 HydrophobicContact CD2-CG1 3.73Å; F365-V395 HydrophobicContact CE1-CG1 3.75Å; F365-V395 HydrophobicContact CE2-CG1 3.76Å; F365-V395 HydrophobicContact CE2-CG2 4.05Å; F365-V395 HydrophobicContact CG-CG1 3.71Å; F365-V395 HydrophobicContact CZ-CB 4.49Å; F365-V395 HydrophobicContact CZ-CG1 3.76Å; F365-V395 HydrophobicContact CZ-CG2 4.34Å; L390-V395 HydrophobicContact CB-CG2 4.43Å; S391-V395 PolarHBondContact O-N 3.16Å; V395-A397 VanDerWaalsContact C-N 3.32Å; V395-A397 PolarHBondContact O-N 3.19Å; V395-I398 PolarHBondContact O-N 3.47Å; V395-C399 PolarHBondContact O-N 2.89Å; V395-C399 PolarHBondContact O-SG 2.77Å; V395-C399 VanDerWaalsContact O-SG 3.4Å
396	K	89.7	Confident	85.9	Confident	119 Å²	119	43.8 Å²	43.8	52%	0.517	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-43.8	174.4	-175.2	-179.4	175.9	-178.6	0	111.6	G392 A393 D394 C399 T400	G392-K396 PolarHBondContact O-N 3.28Å; G392-K396 VanDerWaalsContact O-N 3.11Å; A393-K396 PolarHBondContact O-N 3.09Å; D394-K396 VanDerWaalsContact C-N 3.34Å; D394-K396 PolarHBondContact O-N 3.06Å; K396-C399 PolarHBondContact O-N 2.91Å; K396-T400 WeakPolarHBondContact O-CG2 3.39Å; K396-T400 PolarHBondContact O-N 3.47Å; K396-T400 PolarHBondContact O-OG1 3.38Å
397	A	91.1	Very high	86.7	Confident	30 Å²	30	47.6 Å²	47.6	25%	0.248	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-43.2	178.5	0	0	0	0	0	111.7	A393 D394 V395 T400 E401 V426	A393-A397 WeakPolarHBondContact O-CB 3.41Å; A393-A397 PolarHBondContact O-N 2.87Å; D394-A397 WeakPolarHBondContact O-CB 3.43Å; D394-A397 PolarHBondContact O-N 2.94Å; D394-A397 VanDerWaalsContact O-N 3.13Å; V395-A397 VanDerWaalsContact C-N 3.32Å; V395-A397 PolarHBondContact O-N 3.19Å; A397-T400 WeakPolarHBondContact CA-OG1 3.34Å; A397-T400 PolarHBondContact O-N 3.43Å; A397-T400 PolarHBondContact O-OG1 2.7Å; A397-E401 WeakPolarHBondContact O-CB 3.48Å; A397-E401 WeakPolarHBondContact O-CG 3.21Å; A397-E401 PolarHBondContact O-N 2.81Å; A397-V426 HydrophobicContact CB-CG1 4.3Å; A397-V426 HydrophobicContact CB-CG2 4.15Å
398	I	90.8	Very high	88	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-58.6	-49.3	175.3	-67.9	166.6	0	0	0	110.4	F365 L390 D394 V395 T400 E401 A402 F419 A422 V426	F365-I398 HydrophobicContact CE1-CG2 4.3Å; L390-I398 HydrophobicContact CD1-CD1 4.33Å; L390-I398 HydrophobicContact CD2-CD1 4.28Å; D394-I398 VanDerWaalsContact O-CG1 3.3Å; D394-I398 WeakPolarHBondContact O-CG1 3.35Å; D394-I398 PolarHBondContact O-N 2.76Å; V395-I398 PolarHBondContact O-N 3.47Å; I398-T400 VanDerWaalsContact C-N 3.34Å; I398-T400 PolarHBondContact O-N 3.13Å; I398-E401 PolarHBondContact O-N 3.02Å; I398-A402 WeakPolarHBondContact O-CB 3.49Å; I398-A402 PolarHBondContact O-N 3.45Å; I398-F419 HydrophobicContact CG2-CD1 3.99Å; I398-A422 HydrophobicContact CG2-CB 4.34Å; I398-V426 HydrophobicContact CG1-CB 4.01Å; I398-V426 HydrophobicContact CG1-CG1 4.11Å; I398-V426 HydrophobicContact CG1-CG2 4Å
399	C	90.8	Very high	89	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-43.1	177.8	-66.2	0	0	0	0	111.9	H368 M372 V395 K396 A402 G403	H368-C399 HydrophobicContact CB-CB 4.3Å; M372-C399 WeakPolarHBondContact CE-O 3.45Å; M372-C399 HydrophobicContact SD-CB 4.46Å; V395-C399 PolarHBondContact O-N 2.89Å; V395-C399 PolarHBondContact O-SG 2.77Å; V395-C399 VanDerWaalsContact O-SG 3.4Å; K396-C399 PolarHBondContact O-N 2.91Å; C399-A402 PolarHBondContact O-N 2.73Å; C399-G403 PolarHBondContact O-N 3.05Å
400	T	91.8	Very high	89.6	Confident	75 Å²	75	55.4 Å²	55.4	46%	0.46	28%	0.279	S	S	.	.	H	α-helix	trans	-67.5	-40.6	179.2	50.7	0	0	0	0	113.3	K396 A397 I398 G403 L404	K396-T400 WeakPolarHBondContact O-CG2 3.39Å; K396-T400 PolarHBondContact O-N 3.47Å; K396-T400 PolarHBondContact O-OG1 3.38Å; A397-T400 WeakPolarHBondContact CA-OG1 3.34Å; A397-T400 PolarHBondContact O-N 3.43Å; A397-T400 PolarHBondContact O-OG1 2.7Å; I398-T400 VanDerWaalsContact C-N 3.34Å; I398-T400 PolarHBondContact O-N 3.13Å; T400-G403 PolarHBondContact O-N 3.2Å; T400-L404 WeakPolarHBondContact O-CB 3.43Å; T400-L404 PolarHBondContact O-N 2.88Å
401	E	90.9	Very high	89.9	Confident	43 Å²	43	58.2 Å²	58.2	20%	0.201	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-38.1	177.3	-71.9	-77.7	-180	0	0	110.8	A397 I398 L404 Q405 A422 V426 R429	A397-E401 WeakPolarHBondContact O-CB 3.48Å; A397-E401 WeakPolarHBondContact O-CG 3.21Å; A397-E401 PolarHBondContact O-N 2.81Å; I398-E401 PolarHBondContact O-N 3.02Å; E401-L404 PolarHBondContact O-N 3.18Å; E401-Q405 WeakPolarHBondContact O-CB 3.24Å; E401-Q405 PolarHBondContact O-N 3.37Å; E401-A422 HydrophobicContact CB-CB 3.78Å; E401-V426 HydrophobicContact CG-CG2 4.12Å; E401-R429 IonicContact OE1-CZ 2.78Å; E401-R429 IonicContact OE1-NH1 2.78Å; E401-R429 PolarHBondContact OE1-NH1 2.79Å; E401-R429 IonicContact OE1-NH2 3.79Å; E401-R429 PolarHBondContact OE1-NH2 3.45Å
402	A	91.3	Very high	90.1	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-43.6	174.5	0	0	0	0	0	111.7	I398 C399 L404 Q405 A406 V414 D418 F419 A422	I398-A402 WeakPolarHBondContact O-CB 3.49Å; I398-A402 PolarHBondContact O-N 3.45Å; C399-A402 PolarHBondContact O-N 2.73Å; A402-L404 VanDerWaalsContact C-N 3.33Å; A402-L404 PolarHBondContact O-N 2.77Å; A402-Q405 PolarHBondContact O-N 3.47Å; A402-A406 PolarHBondContact O-N 3.49Å; A402-V414 HydrophobicContact CB-CG1 3.89Å; A402-D418 HydrophobicContact CB-CB 4.37Å; A402-F419 HydrophobicContact CB-CD1 3.77Å; A402-F419 HydrophobicContact CB-CD2 4.39Å; A402-F419 HydrophobicContact CB-CE1 3.92Å; A402-F419 HydrophobicContact CB-CG 4.02Å; A402-F419 HydrophobicContact CB-CZ 4.29Å; A402-A422 HydrophobicContact CB-CB 3.92Å
403	G	91.6	Very high	90.3	Very high	22 Å²	22	69.7 Å²	69.7	23%	0.227	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-38.4	173.4	0	0	0	0	0	112.9	C399 T400 L407	C399-G403 PolarHBondContact O-N 3.05Å; T400-G403 PolarHBondContact O-N 3.2Å; G403-L407 WeakPolarHBondContact O-CB 3.46Å; G403-L407 PolarHBondContact O-N 3.09Å
404	L	91.6	Very high	90.4	Very high	96 Å²	96	67.8 Å²	67.8	50%	0.503	32%	0.32	S	S	.	.	H	α-helix	trans	-68.1	-37.9	177.1	-170.9	62.9	0	0	0	112.1	T400 E401 A402 L407 R408	T400-L404 WeakPolarHBondContact O-CB 3.43Å; T400-L404 PolarHBondContact O-N 2.88Å; E401-L404 PolarHBondContact O-N 3.18Å; A402-L404 VanDerWaalsContact C-N 3.33Å; A402-L404 PolarHBondContact O-N 2.77Å; L404-L407 PolarHBondContact O-N 2.62Å; L404-R408 PolarHBondContact O-N 3.37Å
405	Q	90.4	Very high	90.6	Very high	41 Å²	41	68 Å²	68	19%	0.192	32%	0.322	C	S	.	.	H	α-helix	trans	-67	-42.7	177.1	-171	61.6	25.4	0	0	111.5	E401 A402 L407 R408 D409 D418	E401-Q405 WeakPolarHBondContact O-CB 3.24Å; E401-Q405 PolarHBondContact O-N 3.37Å; A402-Q405 PolarHBondContact O-N 3.47Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 2.91Å; Q405-R408 WeakPolarHBondContact O-CB 3.4Å; Q405-R408 PolarHBondContact O-N 2.64Å; Q405-D409 PolarHBondContact O-N 2.8Å; Q405-D418 HydrophobicContact CB-CB 4.47Å
406	A	90.4	Very high	90.6	Very high	3 Å²	3	68.9 Å²	68.9	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-40.5	172.9	0	0	0	0	0	111.8	A402 D409 R410 R411 V414	A402-A406 PolarHBondContact O-N 3.49Å; A406-D409 PolarHBondContact O-N 3.37Å; A406-R410 PolarHBondContact O-N 2.78Å; A406-R411 CarbonylContact C-O 3.57Å; A406-R411 PolarHBondContact O-N 3.43Å; A406-V414 HydrophobicContact CB-CG2 4.03Å
407	L	91.3	Very high	90.5	Very high	113 Å²	113	69.3 Å²	69.3	59%	0.592	33%	0.33	S	S	*	.	H	α-helix	trans	-65.3	-37.7	176.3	-173.4	64.9	0	0	0	112.4	G403 L404 Q405 D409 R410	G403-L407 WeakPolarHBondContact O-CB 3.46Å; G403-L407 PolarHBondContact O-N 3.09Å; L404-L407 PolarHBondContact O-N 2.62Å; Q405-L407 VanDerWaalsContact C-N 3.3Å; Q405-L407 PolarHBondContact O-N 2.91Å; L407-D409 VanDerWaalsContact C-N 3.25Å; L407-D409 PolarHBondContact O-N 3.27Å; L407-R410 PolarHBondContact O-N 2.83Å
408	R	90.2	Very high	90.6	Very high	185 Å²	185	67.9 Å²	67.9	70%	0.698	32%	0.319	S	S	*	.	H	α-helix	trans	-60.9	-36.1	175.9	-178	178.3	-87.5	160.2	-9.2	111.8	L404 Q405 R410	L404-R408 PolarHBondContact O-N 3.37Å; Q405-R408 WeakPolarHBondContact O-CB 3.4Å; Q405-R408 PolarHBondContact O-N 2.64Å; R408-R410 VanDerWaalsContact C-N 3.26Å; R408-R410 PolarHBondContact O-N 3.48Å
409	D	90.8	Very high	90.5	Very high	76 Å²	76	67.7 Å²	67.7	41%	0.406	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	7	176.2	-65.3	-16.4	0	0	0	113.3	Q405 A406 L407 R411	Q405-D409 PolarHBondContact O-N 2.8Å; A406-D409 PolarHBondContact O-N 3.37Å; L407-D409 VanDerWaalsContact C-N 3.25Å; L407-D409 PolarHBondContact O-N 3.27Å; D409-R411 HydrophobicContact CB-CG 4.36Å; D409-R411 PolarHBondContact O-N 3.17Å; D409-R411 IonicContact OD2-CZ 3Å; D409-R411 IonicContact OD2-NE 2.89Å; D409-R411 IonicContact OD2-NH2 3.37Å; D409-R411 PolarHBondContact OD2-NH2 2.98Å
410	R	89.6	Confident	90.4	Very high	235 Å²	235	71.6 Å²	71.6	89%	0.887	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	29.2	-176	-55.9	-177.5	178.2	-170.7	-0.9	113.7	A406 L407 R408	A406-R410 PolarHBondContact O-N 2.78Å; L407-R410 PolarHBondContact O-N 2.83Å; R408-R410 VanDerWaalsContact C-N 3.26Å; R408-R410 PolarHBondContact O-N 3.48Å
411	R	89.2	Confident	90.3	Very high	75 Å²	75	72.6 Å²	72.6	28%	0.283	33%	0.332	S	S	.	.			trans	-96.7	141.2	175.1	-68.3	-177.3	-75.5	112	-4.7	110	A406 D409 K413 T415 D418	A406-R411 CarbonylContact C-O 3.57Å; A406-R411 PolarHBondContact O-N 3.43Å; D409-R411 HydrophobicContact CB-CG 4.36Å; D409-R411 PolarHBondContact O-N 3.17Å; D409-R411 IonicContact OD2-CZ 3Å; D409-R411 IonicContact OD2-NE 2.89Å; D409-R411 IonicContact OD2-NH2 3.37Å; D409-R411 PolarHBondContact OD2-NH2 2.98Å; R411-K413 PolarHBondContact NH1-O 3.35Å; R411-T415 PolarHBondContact NH1-OG1 3.33Å; R411-D418 IonicContact CZ-OD1 2.77Å; R411-D418 IonicContact CZ-OD2 2.81Å; R411-D418 IonicContact NH1-OD1 3.83Å; R411-D418 IonicContact NH1-OD2 3.42Å; R411-D418 PolarHBondContact NH1-OD2 3.36Å; R411-D418 IonicContact NH2-OD1 3.55Å; R411-D418 PolarHBondContact NH2-OD1 3.5Å; R411-D418 IonicContact NH2-OD2 3.6Å; R411-D418 PolarHBondContact NH2-OD2 2.84Å
412	M	88.1	Confident	90.2	Very high	148 Å²	148	70.8 Å²	70.8	73%	0.729	32%	0.324	S	S	*	.	S	Bend	trans	-95.8	2.8	173.2	-63.7	-58.2	-63.4	0	0	112.6	T373	T373-M412 WeakPolarHBondContact CB-O 3.31Å; T373-M412 PolarHBondContact OG1-O 2.91Å
413	K	90.3	Very high	90	Very high	120 Å²	120	74.3 Å²	74.3	52%	0.522	34%	0.338	S	S	.	.	S	Bend	trans	-121.3	129.8	174.9	-66	-169.8	177.1	-168.8	0	109.5	T373 A375 R411	T373-K413 WeakPolarHBondContact O-CA 3.5Å; A375-K413 HydrophobicContact CB-CB 4.31Å; R411-K413 PolarHBondContact NH1-O 3.35Å
414	V	91.4	Very high	89.7	Confident	8 Å²	8	80 Å²	80	5%	0.048	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-84.6	126.9	175.2	-172.6	0	0	0	0	108.6	T373 A375 A402 A406 D418 F419	T373-V414 PolarHBondContact O-N 3.32Å; A375-V414 WeakPolarHBondContact CB-O 3.25Å; A375-V414 PolarHBondContact N-O 2.98Å; A402-V414 HydrophobicContact CB-CG1 3.89Å; A406-V414 HydrophobicContact CB-CG2 4.03Å; V414-D418 HydrophobicContact CG1-CB 3.89Å; V414-F419 HydrophobicContact CB-CE2 4.33Å; V414-F419 HydrophobicContact CG1-CD2 3.84Å; V414-F419 HydrophobicContact CG1-CE2 3.5Å; V414-F419 VanDerWaalsContact CG1-CE2 3.5Å; V414-F419 HydrophobicContact CG1-CZ 4.15Å
415	T	91.5	Very high	89.5	Confident	31 Å²	31	77.7 Å²	77.7	19%	0.19	35%	0.35	C	S	.	.			trans	-102.9	166.5	-178.5	60.2	0	0	0	0	111.4	A375 R411 E417 D418 F419	A375-T415 HydrophobicContact CB-CG2 4.24Å; R411-T415 PolarHBondContact NH1-OG1 3.33Å; T415-E417 PolarHBondContact O-N 3.5Å; T415-D418 PolarHBondContact N-OD2 3.5Å; T415-D418 WeakPolarHBondContact O-CB 3.36Å; T415-D418 PolarHBondContact O-N 3.32Å; T415-D418 VanDerWaalsContact O-N 3.09Å; T415-D418 PolarHBondContact OG1-OD2 2.9Å; T415-F419 PolarHBondContact O-N 3.13Å
416	Q	88.9	Confident	89.2	Confident	19 Å²	19	76.3 Å²	76.3	9%	0.089	35%	0.345	C	S	.	.	H	α-helix	trans	-59.4	-33.6	177.7	-170.9	70.9	-6.7	0	0	112	D377 D379 E382 D418 F419 K420	D377-Q416 PolarHBondContact OD2-N 3.35Å; D379-Q416 PolarHBondContact O-NE2 2.87Å; E382-Q416 PolarHBondContact OE2-NE2 3.32Å; Q416-D418 VanDerWaalsContact C-N 3.3Å; Q416-D418 PolarHBondContact O-N 3.02Å; Q416-F419 PolarHBondContact O-N 3.38Å; Q416-K420 WeakPolarHBondContact O-CG 3.24Å; Q416-K420 PolarHBondContact O-N 2.87Å
417	E	89.4	Confident	88.8	Confident	128 Å²	128	77.9 Å²	77.9	60%	0.598	35%	0.352	S	S	*	.	H	α-helix	trans	-63.5	-35.1	176.8	-67.7	-166.7	177.4	0	0	112.9	T415 K420 K421	T415-E417 PolarHBondContact O-N 3.5Å; E417-K420 PolarHBondContact O-N 3.47Å; E417-K421 WeakPolarHBondContact O-CG 3.48Å; E417-K421 PolarHBondContact O-N 2.87Å
418	D	91.3	Very high	88.4	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-41.5	178.6	-59.5	-49.6	0	0	0	110.4	A402 Q405 R411 V414 T415 Q416 A422	A402-D418 HydrophobicContact CB-CB 4.37Å; Q405-D418 HydrophobicContact CB-CB 4.47Å; R411-D418 IonicContact CZ-OD1 2.77Å; R411-D418 IonicContact CZ-OD2 2.81Å; R411-D418 IonicContact NH1-OD1 3.83Å; R411-D418 IonicContact NH1-OD2 3.42Å; R411-D418 PolarHBondContact NH1-OD2 3.36Å; R411-D418 IonicContact NH2-OD1 3.55Å; R411-D418 PolarHBondContact NH2-OD1 3.5Å; R411-D418 IonicContact NH2-OD2 3.6Å; R411-D418 PolarHBondContact NH2-OD2 2.84Å; V414-D418 HydrophobicContact CG1-CB 3.89Å; T415-D418 PolarHBondContact N-OD2 3.5Å; T415-D418 WeakPolarHBondContact O-CB 3.36Å; T415-D418 PolarHBondContact O-N 3.32Å; T415-D418 VanDerWaalsContact O-N 3.09Å; T415-D418 PolarHBondContact OG1-OD2 2.9Å; Q416-D418 VanDerWaalsContact C-N 3.3Å; Q416-D418 PolarHBondContact O-N 3.02Å; D418-A422 WeakPolarHBondContact O-CB 3.32Å; D418-A422 PolarHBondContact O-N 2.86Å
419	F	89.7	Confident	87.8	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.4	-38.1	174.8	-79.9	-77.4	0	0	0	112.7	T369 L374 V378 F380 F383 I398 A402 V414 T415 Q416 A422 R423	T369-F419 HydrophobicContact CG2-CZ 4.2Å; L374-F419 HydrophobicContact CD2-CE2 3.91Å; L374-F419 HydrophobicContact CD2-CZ 4.05Å; V378-F419 HydrophobicContact CG1-CD2 4.01Å; V378-F419 HydrophobicContact CG1-CE2 3.84Å; V378-F419 HydrophobicContact CG2-CD2 4.31Å; V378-F419 HydrophobicContact CG2-CE2 4.24Å; F380-F419 HydrophobicContact CE1-CZ 4.36Å; F383-F419 HydrophobicContact CE1-CB 3.87Å; F383-F419 HydrophobicContact CE2-CB 3.73Å; F383-F419 HydrophobicContact CE2-CG 4.24Å; F383-F419 HydrophobicContact CZ-CB 3.24Å; F383-F419 HydrophobicContact CZ-CG 4.21Å; I398-F419 HydrophobicContact CG2-CD1 3.99Å; A402-F419 HydrophobicContact CB-CD1 3.77Å; A402-F419 HydrophobicContact CB-CD2 4.39Å; A402-F419 HydrophobicContact CB-CE1 3.92Å; A402-F419 HydrophobicContact CB-CG 4.02Å; A402-F419 HydrophobicContact CB-CZ 4.29Å; V414-F419 HydrophobicContact CB-CE2 4.33Å; V414-F419 HydrophobicContact CG1-CD2 3.84Å; V414-F419 HydrophobicContact CG1-CE2 3.5Å; V414-F419 VanDerWaalsContact CG1-CE2 3.5Å; V414-F419 HydrophobicContact CG1-CZ 4.15Å; T415-F419 PolarHBondContact O-N 3.13Å; Q416-F419 PolarHBondContact O-N 3.38Å; F419-A422 PolarHBondContact O-N 3.39Å; F419-R423 VanDerWaalsContact O-CB 3.32Å; F419-R423 WeakPolarHBondContact O-CB 3.37Å; F419-R423 PolarHBondContact O-N 3.38Å
420	K	89.4	Confident	87	Confident	86 Å²	86	78.7 Å²	78.7	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-48.7	175.3	-73.7	-177.6	176.1	-174.2	0	111.5	E382 F383 Q416 E417 A422 R423 E424	E382-K420 VanDerWaalsContact OE1-CE 3.22Å; E382-K420 WeakPolarHBondContact OE1-CE 3.13Å; E382-K420 IonicContact OE1-NZ 3.01Å; E382-K420 PolarHBondContact OE1-NZ 2.93Å; E382-K420 VanDerWaalsContact OE2-CE 3.31Å; E382-K420 WeakPolarHBondContact OE2-CE 3.49Å; E382-K420 IonicContact OE2-NZ 3.7Å; E382-K420 PolarHBondContact OE2-NZ 2.92Å; F383-K420 HydrophobicContact CE1-CG 4.21Å; F383-K420 HydrophobicContact CZ-CG 4.27Å; Q416-K420 WeakPolarHBondContact O-CG 3.24Å; Q416-K420 PolarHBondContact O-N 2.87Å; E417-K420 PolarHBondContact O-N 3.47Å; K420-A422 PolarHBondContact O-N 3.27Å; K420-R423 PolarHBondContact O-N 2.97Å; K420-E424 PolarHBondContact O-N 3.45Å; K420-E424 VanDerWaalsContact O-N 3.13Å
421	K	88.9	Confident	86	Confident	96 Å²	96	74.1 Å²	74.1	42%	0.417	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-42.2	175.7	-70.1	172.7	-174.4	162.7	0	112.2	E417 E424 S425	E417-K421 WeakPolarHBondContact O-CG 3.48Å; E417-K421 PolarHBondContact O-N 2.87Å; K421-E424 PolarHBondContact O-N 2.79Å; K421-S425 PolarHBondContact O-N 3.39Å; K421-S425 VanDerWaalsContact O-N 3.11Å
422	A	89.3	Confident	84.7	Confident	4 Å²	4	77.3 Å²	77.3	3%	0.033	35%	0.35	C	S	.	.	H	α-helix	trans	-63.2	-43.7	178	0	0	0	0	0	112	I398 E401 A402 D418 F419 K420 S425 V426	I398-A422 HydrophobicContact CG2-CB 4.34Å; E401-A422 HydrophobicContact CB-CB 3.78Å; A402-A422 HydrophobicContact CB-CB 3.92Å; D418-A422 WeakPolarHBondContact O-CB 3.32Å; D418-A422 PolarHBondContact O-N 2.86Å; F419-A422 PolarHBondContact O-N 3.39Å; K420-A422 PolarHBondContact O-N 3.27Å; A422-S425 PolarHBondContact O-N 3.14Å; A422-V426 WeakPolarHBondContact O-CG2 3.39Å; A422-V426 PolarHBondContact O-N 2.91Å
423	R	86.6	Confident	83.2	Confident	74 Å²	74	73.6 Å²	73.6	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-58.5	-48	175.5	176.1	-175.6	162.7	-155.5	-5.8	111.6	D388 F419 K420 S425 V426 L427	D388-R423 IonicContact OD2-CZ 3.11Å; D388-R423 IonicContact OD2-NE 3.38Å; D388-R423 PolarHBondContact OD2-NE 3.08Å; D388-R423 IonicContact OD2-NH2 3.72Å; D388-R423 PolarHBondContact OD2-NH2 3.11Å; F419-R423 VanDerWaalsContact O-CB 3.32Å; F419-R423 WeakPolarHBondContact O-CB 3.37Å; F419-R423 PolarHBondContact O-N 3.38Å; K420-R423 PolarHBondContact O-N 2.97Å; R423-S425 VanDerWaalsContact C-N 3.34Å; R423-S425 PolarHBondContact O-N 2.83Å; R423-V426 PolarHBondContact O-N 3.31Å; R423-L427 VanDerWaalsContact O-CB 3.24Å; R423-L427 WeakPolarHBondContact O-CB 3.42Å; R423-L427 PolarHBondContact O-N 3.43Å
424	E	86.4	Confident	81.5	Confident	142 Å²	142	70.9 Å²	70.9	66%	0.664	35%	0.35	S	S	*	.	H	α-helix	trans	-60	-44.5	179	-72.9	178.8	176.6	0	0	111.8	K420 K421 Y428	K420-E424 PolarHBondContact O-N 3.45Å; K420-E424 VanDerWaalsContact O-N 3.13Å; K421-E424 PolarHBondContact O-N 2.79Å; E424-Y428 WeakPolarHBondContact O-CB 2.97Å; E424-Y428 PolarHBondContact O-N 3.19Å
425	S	85.4	Confident	79.4	Confident	47 Å²	47	76.2 Å²	76.2	33%	0.329	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-47	177.3	-177.3	0	0	0	0	112.5	K421 A422 R423 Y428 R429	K421-S425 PolarHBondContact O-N 3.39Å; K421-S425 VanDerWaalsContact O-N 3.11Å; A422-S425 PolarHBondContact O-N 3.14Å; R423-S425 VanDerWaalsContact C-N 3.34Å; R423-S425 PolarHBondContact O-N 2.83Å; S425-Y428 PolarHBondContact O-N 3.38Å; S425-R429 PolarHBondContact O-N 3.5Å
426	V	85	Confident	77.1	Confident	12 Å²	12	79.2 Å²	79.2	7%	0.073	41%	0.412	C	S	.	.	H	α-helix	trans	-69.4	-41.6	-179.3	174.8	0	0	0	0	111.3	A397 I398 E401 A422 R423 Y428 R429 K430	A397-V426 HydrophobicContact CB-CG1 4.3Å; A397-V426 HydrophobicContact CB-CG2 4.15Å; I398-V426 HydrophobicContact CG1-CB 4.01Å; I398-V426 HydrophobicContact CG1-CG1 4.11Å; I398-V426 HydrophobicContact CG1-CG2 4Å; E401-V426 HydrophobicContact CG-CG2 4.12Å; A422-V426 WeakPolarHBondContact O-CG2 3.39Å; A422-V426 PolarHBondContact O-N 2.91Å; R423-V426 PolarHBondContact O-N 3.31Å; V426-Y428 VanDerWaalsContact C-N 3.32Å; V426-Y428 PolarHBondContact O-N 2.86Å; V426-R429 PolarHBondContact O-N 3.33Å; V426-K430 PolarHBondContact O-N 3.01Å; V426-K430 VanDerWaalsContact O-N 3.12Å
427	L	82.3	Confident	75.2	Confident	36 Å²	36	82.6 Å²	82.6	19%	0.188	44%	0.444	C	S	.	.	H	α-helix	trans	-66.3	-35.7	178.4	-171.1	65.7	0	0	0	111.7	R423 K430 K431	R423-L427 VanDerWaalsContact O-CB 3.24Å; R423-L427 WeakPolarHBondContact O-CB 3.42Å; R423-L427 PolarHBondContact O-N 3.43Å; L427-K430 PolarHBondContact O-N 3.13Å; L427-K431 HydrophobicContact CG-CD 4.48Å; L427-K431 WeakPolarHBondContact O-CG 3.2Å; L427-K431 PolarHBondContact O-N 3.05Å
428	Y	82.4	Confident	73.4	Confident	153 Å²	153	84.2 Å²	84.2	60%	0.6	46%	0.456	S	S	*	.	H	α-helix	trans	-61.4	-47.3	174.2	-171.3	-96.2	0	0	0	111.3	E424 S425 V426 K430 K431 E432	E424-Y428 WeakPolarHBondContact O-CB 2.97Å; E424-Y428 PolarHBondContact O-N 3.19Å; S425-Y428 PolarHBondContact O-N 3.38Å; V426-Y428 VanDerWaalsContact C-N 3.32Å; V426-Y428 PolarHBondContact O-N 2.86Å; Y428-K430 PolarHBondContact O-N 3.13Å; Y428-K431 PolarHBondContact O-N 3.12Å; Y428-K431 VanDerWaalsContact O-N 3.16Å; Y428-E432 HydrophobicContact CE1-CG 4.22Å; Y428-E432 VanDerWaalsContact CE1-OE1 3.26Å; Y428-E432 WeakPolarHBondContact CE1-OE1 3.29Å; Y428-E432 PolarHBondContact O-N 3.37Å
429	R	78.9	Confident	71.5	Confident	152 Å²	152	94.3 Å²	94.3	57%	0.574	50%	0.495	S	S	*	.	H	α-helix	trans	-57.9	-36.8	175.1	-71.3	-177.5	-178.4	156.5	8.3	112.6	E401 S425 V426	E401-R429 IonicContact OE1-CZ 2.78Å; E401-R429 IonicContact OE1-NH1 2.78Å; E401-R429 PolarHBondContact OE1-NH1 2.79Å; E401-R429 IonicContact OE1-NH2 3.79Å; E401-R429 PolarHBondContact OE1-NH2 3.45Å; S425-R429 PolarHBondContact O-N 3.5Å; V426-R429 PolarHBondContact O-N 3.33Å
430	K	73.7	Confident	68.8	Low	86 Å²	86	106.2 Å²	106.2	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-70.6	-38.9	178.5	-168.4	169.7	-175.1	164.8	0	112.4	D389 D394 V426 L427 Y428 G433	D389-K430 PolarHBondContact O-NZ 3.5Å; D394-K430 IonicContact OD2-NZ 3.47Å; D394-K430 PolarHBondContact OD2-NZ 3.34Å; V426-K430 PolarHBondContact O-N 3.01Å; V426-K430 VanDerWaalsContact O-N 3.12Å; L427-K430 PolarHBondContact O-N 3.13Å; Y428-K430 PolarHBondContact O-N 3.13Å; K430-G433 PolarHBondContact O-N 3.33Å
431	K	68.3	Low	67.8	Low	139 Å²	139	107.3 Å²	107.3	60%	0.604	57%	0.567	S	S	*	*	H	α-helix	trans	-69.8	-29.2	-179	-75.6	-179.4	179.3	179.7	0	113.4	L427 Y428 G433 A434	L427-K431 HydrophobicContact CG-CD 4.48Å; L427-K431 WeakPolarHBondContact O-CG 3.2Å; L427-K431 PolarHBondContact O-N 3.05Å; Y428-K431 PolarHBondContact O-N 3.12Å; Y428-K431 VanDerWaalsContact O-N 3.16Å; K431-G433 PolarHBondContact O-N 3.09Å; K431-A434 PolarHBondContact O-N 2.96Å
432	E	60.8	Low	66.7	Low	142 Å²	142	107.8 Å²	107.8	66%	0.664	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-23.2	174.3	-72.3	-171.7	155.5	0	0	113.3	Y428	Y428-E432 HydrophobicContact CE1-CG 4.22Å; Y428-E432 VanDerWaalsContact CE1-OE1 3.26Å; Y428-E432 WeakPolarHBondContact CE1-OE1 3.29Å; Y428-E432 PolarHBondContact O-N 3.37Å
433	G	56.8	Low	65.5	Low	70 Å²	70	113.6 Å²	113.6	72%	0.722	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-9.4	-179.9	0	0	0	0	0	115.8	K430 K431	K430-G433 PolarHBondContact O-N 3.33Å; K431-G433 PolarHBondContact O-N 3.09Å
434	A	55	Low	64.2	Low	63 Å²	63	115.9 Å²	115.9	52%	0.521	62%	0.624	S	S	.	*	S	Bend	trans	-98.9	124	-176	0	0	0	0	0	110.9	K431 A436	K431-A434 PolarHBondContact O-N 2.96Å; A434-A436 PolarHBondContact O-N 2.94Å
435	P	48.1	Very low	62.8	Low	121 Å²	121	114.3 Å²	114.3	79%	0.786	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.7	164.3	23.9	-29.2	0	0	0	108.2	A437	P435-A437 PolarHBondContact O-N 3.05Å
436	A	42.9	Very low	61.3	Low	93 Å²	93	118.8 Å²	118.8	77%	0.769	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-46.5	129.8	-177.4	0	0	0	0	0	111.1	A434 L438	A434-A436 PolarHBondContact O-N 2.94Å; A436-L438 PolarHBondContact O-N 3.35Å
437	A	48.6	Very low	59.6	Low	91 Å²	91	126.4 Å²	126.4	75%	0.752	68%	0.682	S	S	*	*			trans	-41.1	119.9	-174	0	0	0	0	0	113.1	P435 Y439	P435-A437 PolarHBondContact O-N 3.05Å; A437-Y439 PolarHBondContact O-N 3.24Å
438	L	51.4	Low	57.9	Low	162 Å²	162	133.4 Å²	133.4	85%	0.848	72%	0.719	S	S	*	*	S	Bend	trans	-80.9	3.9	171.8	-105.1	133.3	0	0	0	113.1	A436	A436-L438 PolarHBondContact O-N 3.35Å
439	Y	50.9	Low	55.8	Low	212 Å²	212	131.8 Å²	131.8	83%	0.831	73%	0.729	S	S	*	*			trans	-118.9	119.3	-179.8	-64.7	-78.8	0	0	0	109.4	A437	A437-Y439 PolarHBondContact O-N 3.24Å
440	L	34.9	Very low	53.7	Low	250 Å²	250	129.9 Å²	129.9	100%	1.309	74%	0.744	S	S	*	*			trans	-70.8	0	172.6	-100.9	143.3	0	0	0	111.8

Retrieved 440 of 440 residues in 108.6 ms (Link to these results)

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