A0A077ZAV9_TRITR Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZAV9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 236 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	50	Low	58.5	Low	243 Å²	243	154.1 Å²	154.1	100%	1.197	86%	0.858	S	S	*	*				0	108.6	0	-71.1	-169.3	169.5	0	0	107.6
2	S	59.9	Low	58.3	Low	128 Å²	128	148.3 Å²	148.3	90%	0.895	86%	0.859	S	S	*	*			trans	-161.4	126.9	160.1	-77.9	0	0	0	0	106.2
3	E	63.4	Low	57.6	Low	198 Å²	198	153 Å²	153	93%	0.925	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-81.7	155	-159.1	-65.8	155.8	114.2	0	0	113.8
4	K	65.7	Low	57.8	Low	198 Å²	198	152.9 Å²	152.9	86%	0.861	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-94.3	150.4	158.8	-86.4	-178.8	173.3	178	0	108.7
5	P	71.2	Confident	57.4	Low	129 Å²	129	151.2 Å²	151.2	84%	0.838	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-96.2	152.3	161.3	32.2	-23.1	0	0	0	112.8
6	E	64.6	Low	57.3	Low	175 Å²	175	147.1 Å²	147.1	82%	0.818	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-94.2	168.2	-173.9	-60.6	177.4	117.9	0	0	113.4
7	D	56.1	Low	56.7	Low	139 Å²	139	147.6 Å²	147.6	74%	0.743	87%	0.868	S	S	*	*			trans	98.6	139.7	137.4	-80.6	-31.4	0	0	0	125.2
8	N	55.8	Low	56.4	Low	138 Å²	138	145 Å²	145	74%	0.738	87%	0.866	S	S	*	*			trans	110.6	95.5	147.4	-82.4	-33.8	0	0	0	121.8
9	S	49.2	Very low	55.9	Low	100 Å²	100	142.7 Å²	142.7	70%	0.699	86%	0.858	S	S	*	*				55.5	119.2	107.9	-54.3	0	0	0	0	121.2
10	S	59.4	Low	55.6	Low	125 Å²	125	148.2 Å²	148.2	87%	0.874	86%	0.863	S	S	*	*				171.1	148	106.8	67.4	0	0	0	0	113.2
11	S	48.1	Very low	55.2	Low	122 Å²	122	146.3 Å²	146.3	85%	0.853	86%	0.858	S	S	*	*			trans	-90.4	148.2	-176.2	52.2	0	0	0	0	113.7
12	G	56.3	Low	55.3	Low	84 Å²	84	140.6 Å²	140.6	87%	0.866	84%	0.841	S	S	*	*			trans	-142.9	115.9	164.6	0	0	0	0	0	112.6
13	K	48.9	Very low	54.5	Low	210 Å²	210	140.3 Å²	140.3	91%	0.913	84%	0.835	S	S	*	*			trans	-102.4	137.4	168.3	-87.1	177.7	171.7	174.5	0	108.8
14	T	60.3	Low	54	Low	152 Å²	152	139.1 Å²	139.1	93%	0.933	83%	0.834	S	S	*	*			trans	-152	142	145.7	49.7	0	0	0	0	110.6
15	S	51.9	Low	53.1	Low	127 Å²	127	137.8 Å²	137.8	89%	0.888	83%	0.831	S	S	*	*			trans	-97.1	154.2	-179.2	45.5	0	0	0	0	111.8
16	G	55.9	Low	52	Low	85 Å²	85	136.7 Å²	136.7	88%	0.876	82%	0.823	S	S	*	*			trans	-158.5	108.3	171.3	0	0	0	0	0	111.5
17	D	47.5	Very low	51.1	Low	156 Å²	156	136.9 Å²	136.9	83%	0.834	82%	0.824	S	S	*	*			trans	-94.4	142.1	-177.7	-162	-11.1	0	0	0	109.8
18	A	50.7	Low	51	Low	101 Å²	101	138.1 Å²	138.1	84%	0.835	83%	0.831	S	S	*	*			trans	-159.9	104.3	167	0	0	0	0	0	111.8
19	S	46.7	Very low	50.7	Low	102 Å²	102	141.4 Å²	141.4	71%	0.713	84%	0.839	S	S	*	*			trans	-63.8	152	171.8	-54.3	0	0	0	0	113.7
20	R	50	Low	50.6	Low	252 Å²	252	139.6 Å²	139.6	95%	0.951	84%	0.836	S	S	*	*				173.7	137.1	116.5	-94.7	171.3	154.7	-179.6	-7.3	113.6
21	S	47.7	Very low	49.8	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	84%	0.837	S	S	*	*			trans	-92.9	151.9	-177.8	-179	0	0	0	0	111.6
22	S	51.3	Low	50.2	Low	122 Å²	122	141.6 Å²	141.6	85%	0.853	83%	0.831	S	S	*	*			trans	-169.3	134.4	133.2	51.4	0	0	0	0	113
23	T	44.5	Very low	49.6	Very low	123 Å²	123	143.9 Å²	143.9	76%	0.755	82%	0.824	S	S	*	*			trans	-65.7	150.8	178	-48.6	0	0	0	0	113.9
24	L	51.8	Low	49.2	Very low	173 Å²	173	139.4 Å²	139.4	91%	0.906	82%	0.818	S	S	*	*			trans	-172.7	105.8	143.3	-97	163.8	0	0	0	110
25	E	48	Very low	48.8	Very low	170 Å²	170	136.3 Å²	136.3	79%	0.794	80%	0.803	S	S	*	*			trans	-92.9	160.3	151.9	-74.9	-115.6	126.4	0	0	106.7
26	P	46.4	Very low	48.3	Very low	105 Å²	105	139.3 Å²	139.3	68%	0.682	80%	0.8	S	S	*	*			cis	-151.3	169.4	48.3	36.6	-12.2	0	0	0	118.6
27	E	46.3	Very low	47.7	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	80%	0.798	S	S	*	*			trans	40.1	113.1	144.4	-61.4	-176.2	125.1	0	0	120.8
28	N	53.8	Low	47.4	Very low	166 Å²	166	142.5 Å²	142.5	89%	0.888	80%	0.797	S	S	*	*			trans	-148.6	127.8	140.7	-143.3	-11.6	0	0	0	112.3	G30	N28-G30 PolarHBondContact O-N 3.29Å
29	K	50.4	Low	46.8	Very low	207 Å²	207	140.1 Å²	140.1	90%	0.9	78%	0.782	S	S	*	*			trans	-73.4	118.9	-178.2	-68.7	172.7	178.1	172.3	0	109.7
30	G	46.5	Very low	46.9	Very low	62 Å²	62	142.1 Å²	142.1	64%	0.639	78%	0.778	S	S	*	*			trans	-137.5	104.5	172.4	0	0	0	0	0	110	N28 V32	N28-G30 PolarHBondContact O-N 3.29Å; G30-V32 PolarHBondContact O-N 3.08Å; G30-V32 VanDerWaalsContact O-N 3.13Å
31	N	42.8	Very low	46.7	Very low	169 Å²	169	137.6 Å²	137.6	90%	0.904	77%	0.767	S	S	*	*			trans	-58.1	106.6	171.2	-173	25	0	0	0	109.1
32	V	56	Low	46.9	Very low	120 Å²	120	136.2 Å²	136.2	73%	0.727	76%	0.756	S	S	*	*			trans	-103.1	103.8	172.5	173.9	0	0	0	0	107.9	G30 S34	G30-V32 PolarHBondContact O-N 3.08Å; G30-V32 VanDerWaalsContact O-N 3.13Å; V32-S34 PolarHBondContact O-N 2.88Å; V32-S34 VanDerWaalsContact O-N 3.09Å; V32-S34 PolarHBondContact O-OG 3.18Å
33	D	44.9	Very low	47	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	75%	0.747	S	S	*	*			trans	-49.9	110.6	166	-156.5	-15.5	0	0	0	108.8	S35	D33-S35 PolarHBondContact O-N 3.04Å
34	S	40.8	Very low	47.5	Very low	115 Å²	115	135.6 Å²	135.6	80%	0.804	74%	0.74	S	S	*	*			trans	-84.6	65.6	-178.3	-67.1	0	0	0	0	108.9	V32 K36	V32-S34 PolarHBondContact O-N 2.88Å; V32-S34 VanDerWaalsContact O-N 3.09Å; V32-S34 PolarHBondContact O-OG 3.18Å; S34-K36 PolarHBondContact O-N 2.78Å
35	S	51.6	Low	48	Very low	87 Å²	87	132 Å²	132	61%	0.608	72%	0.717	S	S	*	*			trans	-82	101.2	174.4	-3.1	0	0	0	0	109.5	D33 T37	D33-S35 PolarHBondContact O-N 3.04Å; S35-T37 PolarHBondContact O-N 3.01Å
36	K	40.6	Very low	48.4	Very low	190 Å²	190	128.1 Å²	128.1	83%	0.826	71%	0.705	S	S	*	*			trans	26.3	85.6	149.7	-77.5	178	170.9	177.7	0	116	S34	S34-K36 PolarHBondContact O-N 2.78Å
37	T	44	Very low	49.1	Very low	136 Å²	136	123.5 Å²	123.5	83%	0.834	68%	0.675	S	S	*	*			trans	-101	89.2	141.7	59.7	0	0	0	0	107	S35 G39	S35-T37 PolarHBondContact O-N 3.01Å; T37-G39 PolarHBondContact O-N 2.81Å
38	E	41	Very low	49.7	Very low	172 Å²	172	119.7 Å²	119.7	80%	0.804	66%	0.66	S	S	*	*			trans	-59	95.2	157.4	-79	-175.1	121.5	0	0	106.5	K40	E38-K40 VanDerWaalsContact C-N 3.34Å; E38-K40 PolarHBondContact O-N 2.92Å
39	G	37.5	Very low	49.7	Very low	51 Å²	51	112.6 Å²	112.6	53%	0.526	62%	0.621	S	S	.	*			trans	-56.9	103.3	167.8	0	0	0	0	0	107	T37 H41	T37-G39 PolarHBondContact O-N 2.81Å; G39-H41 PolarHBondContact O-CD2 3.38Å; G39-H41 PolarHBondContact O-N 3.39Å
40	K	49	Very low	49.9	Very low	144 Å²	144	108 Å²	108	63%	0.626	61%	0.611	S	S	*	*			trans	-58.6	89	170.5	-77.7	167.2	165.1	-172.3	0	107.7	E38 I118	E38-K40 VanDerWaalsContact C-N 3.34Å; E38-K40 PolarHBondContact O-N 2.92Å; K40-I118 HydrophobicContact CB-CD1 4.18Å; K40-I118 HydrophobicContact CD-CD1 3.59Å; K40-I118 HydrophobicContact CG-CD1 3.71Å
41	H	45.1	Very low	50.1	Low	157 Å²	157	106.7 Å²	106.7	73%	0.727	59%	0.591	S	S	*	*			trans	-61.7	127.7	174.1	-72.9	-78.3	0	0	0	107.8	G39 H43	G39-H41 PolarHBondContact O-CD2 3.38Å; G39-H41 PolarHBondContact O-N 3.39Å; H41-H43 PolarHBondContact O-N 3.21Å
42	P	52.7	Low	50.3	Low	81 Å²	81	104.9 Å²	104.9	53%	0.526	59%	0.589	S	S	.	*			trans	-59.4	118.5	171.6	24.8	-32	0	0	0	107.7	S44 E115	P42-S44 PolarHBondContact O-N 2.76Å; P42-E115 HydrophobicContact CB-CG 4.21Å
43	H	53.1	Low	50	Low	144 Å²	144	100.7 Å²	100.7	67%	0.667	57%	0.57	S	S	*	*			trans	-72.1	96.1	172.7	-68.6	-71.3	0	0	0	108.4	H41 K45	H41-H43 PolarHBondContact O-N 3.21Å; H43-K45 PolarHBondContact O-N 2.98Å
44	S	54.5	Low	50.7	Low	87 Å²	87	99.4 Å²	99.4	61%	0.608	57%	0.569	S	S	*	*			trans	-65.8	106	169.5	65.4	0	0	0	0	108.7	P42	P42-S44 PolarHBondContact O-N 2.76Å
45	K	62.4	Low	52	Low	99 Å²	99	94.7 Å²	94.7	43%	0.43	54%	0.535	S	S	.	.	B	Isolated β-bridge	trans	-96.7	123.6	169.8	-72.7	-175.1	176.7	-174.6	0	109.4	H43 L112 I114	H43-K45 PolarHBondContact O-N 2.98Å; K45-L112 CarbonylContact C-O 3.59Å; K45-L112 CarbonylContact O-C 3.56Å; K45-I114 HydrophobicContact CB-CD1 4.08Å; K45-I114 HydrophobicContact CB-CG1 3.93Å
46	V	58	Low	53	Low	87 Å²	87	91.4 Å²	91.4	53%	0.527	52%	0.515	S	S	.	.			trans	-75.8	122.9	165.4	178.1	0	0	0	0	107.6	K111 L112	V46-K111 HydrophobicContact CG1-CB 3.82Å; V46-K111 HydrophobicContact CG1-CD 3.85Å; V46-K111 HydrophobicContact CG1-CG 3.57Å; V46-L112 WeakPolarHBondContact CA-O 3.34Å
47	V	60	Low	54.8	Low	9 Å²	9	83.2 Å²	83.2	6%	0.055	49%	0.485	C	S	.	.			trans	-113.5	125.5	177	171.7	0	0	0	0	107.6	S79 L112 I114	V47-S79 WeakPolarHBondContact CG1-OG 3.32Å; V47-L112 HydrophobicContact CB-CB 4Å; V47-L112 HydrophobicContact CB-CD1 4.01Å; V47-L112 HydrophobicContact CB-CG 4.2Å; V47-L112 HydrophobicContact CG1-CD1 4.11Å; V47-L112 HydrophobicContact CG2-CB 4.35Å; V47-L112 HydrophobicContact CG2-CD1 4.46Å; V47-I114 HydrophobicContact CG2-CD1 4.32Å
48	D	58.2	Low	56.8	Low	99 Å²	99	77.4 Å²	77.4	53%	0.529	45%	0.448	S	S	.	.			trans	-88.1	136.2	169	-64.8	-41.5	0	0	0	109.7	V50	D48-V50 PolarHBondContact O-N 2.88Å
49	K	55.8	Low	59.1	Low	17 Å²	17	75.8 Å²	75.8	7%	0.074	44%	0.439	C	S	.	.			trans	-71.6	124.8	172.6	-171.7	-175.5	-164.2	177.8	0	109.4	S51 G53 W76 P108 F110	K49-S51 VanDerWaalsContact CD-O 3.3Å; K49-S51 WeakPolarHBondContact CD-O 2.91Å; K49-S51 WeakPolarHBondContact CE-O 3.38Å; K49-S51 WeakPolarHBondContact CG-O 3.4Å; K49-G53 WeakPolarHBondContact CE-O 3.49Å; K49-G53 PolarHBondContact NZ-O 2.91Å; K49-W76 HydrophobicContact CB-CH2 4.35Å; K49-W76 HydrophobicContact CD-CH2 4.23Å; K49-W76 HydrophobicContact CG-CH2 3.68Å; K49-W76 HydrophobicContact CG-CZ2 4.27Å; K49-W76 HydrophobicContact CG-CZ3 4.37Å; K49-P108 WeakPolarHBondContact CD-O 3.3Å; K49-F110 HydrophobicContact CB-CE1 4.18Å; K49-F110 HydrophobicContact CB-CZ 4.26Å; K49-F110 HydrophobicContact CD-CE1 3.72Å; K49-F110 HydrophobicContact CD-CZ 4.22Å; K49-F110 HydrophobicContact CG-CE1 4.39Å; K49-F110 HydrophobicContact CG-CZ 4.49Å
50	V	53.5	Low	61.6	Low	111 Å²	111	74.2 Å²	74.2	67%	0.673	42%	0.418	S	S	*	.			trans	-89.6	-14.4	-176.8	-172.2	0	0	0	0	112.2	D48	D48-V50 PolarHBondContact O-N 2.88Å
51	S	49.7	Very low	63.5	Low	34 Å²	34	71.2 Å²	71.2	24%	0.238	41%	0.412	C	S	.	.			trans	-119.5	124.9	-176.2	54.8	0	0	0	0	113.7	K49 G53	K49-S51 VanDerWaalsContact CD-O 3.3Å; K49-S51 WeakPolarHBondContact CD-O 2.91Å; K49-S51 WeakPolarHBondContact CE-O 3.38Å; K49-S51 WeakPolarHBondContact CG-O 3.4Å; S51-G53 PolarHBondContact O-N 2.82Å; S51-G53 VanDerWaalsContact O-N 3.13Å
52	P	47.1	Very low	65.4	Low	130 Å²	130	65.7 Å²	65.7	84%	0.844	40%	0.397	S	S	*	.	S	Bend	trans	-78.7	92.9	170.9	30.9	-30.8	0	0	0	109.3
53	G	49.7	Very low	67	Low	33 Å²	33	69 Å²	69	34%	0.34	41%	0.406	S	S	.	.	S	Bend	trans	-172.2	171.6	176.6	0	0	0	0	0	111.6	K49 S51	K49-G53 WeakPolarHBondContact CE-O 3.49Å; K49-G53 PolarHBondContact NZ-O 2.91Å; S51-G53 PolarHBondContact O-N 2.82Å; S51-G53 VanDerWaalsContact O-N 3.13Å
54	P	59.5	Low	68.5	Low	105 Å²	105	64.7 Å²	64.7	68%	0.682	39%	0.391	S	S	*	.	S	Bend	trans	-52.4	148.3	167.5	24.5	-32.2	0	0	0	109.1	G56	P54-G56 PolarHBondContact O-N 2.86Å
55	V	68.1	Low	70.2	Confident	16 Å²	16	60.7 Å²	60.7	10%	0.097	36%	0.363	C	S	.	.			trans	-71	71.7	178.8	-177.7	0	0	0	0	107.3	I58 W76 M104 N105	V55-I58 HydrophobicContact CG1-CD1 3.82Å; V55-I58 HydrophobicContact CG1-CG1 4.36Å; V55-W76 HydrophobicContact CG1-CZ2 3.99Å; V55-M104 HydrophobicContact CB-CB 4.2Å; V55-M104 HydrophobicContact CG1-CB 4.12Å; V55-M104 HydrophobicContact CG1-CE 3.68Å; V55-M104 HydrophobicContact CG1-SD 4.07Å; V55-M104 VanDerWaalsContact CG2-C 3.42Å; V55-M104 HydrophobicContact CG2-CB 3.35Å; V55-M104 VanDerWaalsContact CG2-O 3.31Å; V55-M104 WeakPolarHBondContact CG2-O 3.4Å; V55-N105 VanDerWaalsContact CB-OD1 3.29Å; V55-N105 WeakPolarHBondContact CB-OD1 3.3Å; V55-N105 WeakPolarHBondContact CG2-OD1 3.37Å; V55-N105 PolarHBondContact N-OD1 2.73Å
56	G	73.5	Confident	71.5	Confident	17 Å²	17	57.5 Å²	57.5	18%	0.175	35%	0.352	C	S	.	.			trans	-80.7	161.7	168	0	0	0	0	0	109.6	P54 I58 Y74 W76	P54-G56 PolarHBondContact O-N 2.86Å; G56-I58 VanDerWaalsContact C-N 3.28Å; G56-I58 PolarHBondContact O-N 3.25Å; G56-Y74 WeakPolarHBondContact O-CD1 3.33Å; G56-W76 PolarHBondContact O-NE1 3.13Å
57	G	79.3	Confident	73.1	Confident	19 Å²	19	53.4 Å²	53.4	20%	0.196	33%	0.327	C	S	.	.	S	Bend	trans	73.3	11.3	173.7	0	0	0	0	0	116.2	L70 D71 Y74	G57-L70 CarbonylContact O-C 3.58Å; G57-L70 WeakPolarHBondContact O-CA 3.38Å; G57-D71 VanDerWaalsContact CA-CB 3.45Å; G57-D71 PolarHBondContact O-N 3.23Å; G57-Y74 VanDerWaalsContact CA-CD2 3.49Å
58	I	86.2	Confident	74.5	Confident	13 Å²	13	56.3 Å²	56.3	7%	0.067	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.7	169.9	-54.4	176.5	0	0	0	109.6	V55 G56 L60 V67 L70 W76 L80 M104	V55-I58 HydrophobicContact CG1-CD1 3.82Å; V55-I58 HydrophobicContact CG1-CG1 4.36Å; G56-I58 VanDerWaalsContact C-N 3.28Å; G56-I58 PolarHBondContact O-N 3.25Å; I58-L60 HydrophobicContact CG2-CD2 3.56Å; I58-L60 HydrophobicContact CG2-CG 3.8Å; I58-V67 HydrophobicContact CG2-CG1 4.48Å; I58-L70 HydrophobicContact CB-CD2 4.3Å; I58-L70 HydrophobicContact CG1-CD2 3.84Å; I58-L70 HydrophobicContact CG2-CD2 4.06Å; I58-W76 HydrophobicContact CD1-CD2 3.47Å; I58-W76 VanDerWaalsContact CD1-CD2 3.47Å; I58-W76 HydrophobicContact CD1-CE3 3.85Å; I58-W76 HydrophobicContact CD1-CG 3.85Å; I58-W76 HydrophobicContact CD1-CH2 4.03Å; I58-W76 HydrophobicContact CD1-CZ2 3.67Å; I58-W76 HydrophobicContact CD1-CZ3 4.12Å; I58-W76 HydrophobicContact CG1-CB 4.48Å; I58-W76 VanDerWaalsContact CG1-CD1 3.44Å; I58-W76 HydrophobicContact CG1-CD2 3.88Å; I58-W76 HydrophobicContact CG1-CG 3.72Å; I58-W76 HydrophobicContact CG1-CZ2 4.41Å; I58-L80 HydrophobicContact CD1-CD1 3.68Å; I58-M104 HydrophobicContact CD1-CE 3.61Å
59	K	88.1	Confident	75.8	Confident	139 Å²	139	53.4 Å²	53.4	60%	0.604	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.6	169.2	-164.4	172.2	-177.2	176.2	0	109.8	V68 A69	K59-V68 PolarHBondContact O-N 2.68Å; K59-A69 HydrophobicContact CB-CB 3.88Å; K59-A69 HydrophobicContact CD-CB 4.41Å; K59-A69 PolarHBondContact N-O 3.35Å; K59-A69 PolarHBondContact O-N 3.49Å
60	L	90	Very high	77.3	Confident	17 Å²	17	54 Å²	54	9%	0.089	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	145.9	178.6	-61.1	178.6	0	0	0	110.9	I58 T66 V67 I86 A97 C100 Q101 M104	I58-L60 HydrophobicContact CG2-CD2 3.56Å; I58-L60 HydrophobicContact CG2-CG 3.8Å; L60-T66 CarbonylContact C-O 3.49Å; L60-T66 VanDerWaalsContact CA-O 3.31Å; L60-T66 WeakPolarHBondContact CA-O 3.37Å; L60-V67 HydrophobicContact CD2-CB 4.37Å; L60-V67 HydrophobicContact CD2-CG2 3.74Å; L60-I86 HydrophobicContact CD1-CD1 4.04Å; L60-I86 HydrophobicContact CD2-CD1 3.72Å; L60-A97 HydrophobicContact CB-CB 3.83Å; L60-C100 HydrophobicContact CD1-CB 3.74Å; L60-C100 WeakPolarHBondContact CD1-SG 3.11Å; L60-Q101 HydrophobicContact CD1-CG 4.15Å; L60-M104 HydrophobicContact CD1-SD 4.44Å
61	T	89	Confident	78.7	Confident	81 Å²	81	52.7 Å²	52.7	50%	0.497	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	160.1	172.5	-159.7	0	0	0	0	112.5	T66 V68	T61-T66 PolarHBondContact N-O 3.36Å; T61-T66 PolarHBondContact O-N 3.42Å; T61-V68 HydrophobicContact CG2-CG2 3.17Å
62	G	85.9	Confident	80	Confident	41 Å²	41	58.5 Å²	58.5	42%	0.423	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-171.6	167.6	0	0	0	0	0	116.1	P64	G62-P64 CarbonylContact C-O 3.45Å
63	Q	86.6	Confident	81.4	Confident	151 Å²	151	55.7 Å²	55.7	71%	0.706	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.5	111.8	175.4	-67.3	-175.7	-12.9	0	0	108.1	Q95 D96	Q63-Q95 WeakPolarHBondContact CG-O 3.43Å; Q63-Q95 PolarHBondContact NE2-O 2.78Å; Q63-D96 HydrophobicContact CG-CB 4.25Å
64	P	84.4	Confident	82.7	Confident	54 Å²	54	59.2 Å²	59.2	35%	0.351	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	cis	-65.2	157.4	0.5	30.6	-36.4	0	0	0	112.7	G62 T66 K85 L87	G62-P64 CarbonylContact C-O 3.45Å; P64-T66 PolarHBondContact O-N 2.91Å; P64-T66 VanDerWaalsContact O-N 3.16Å; P64-T66 PolarHBondContact O-OG1 2.84Å; P64-T66 VanDerWaalsContact O-OG1 3.05Å; P64-K85 HydrophobicContact CG-CB 4.39Å; P64-K85 HydrophobicContact CG-CD 4.06Å; P64-K85 HydrophobicContact CG-CG 4.44Å; P64-L87 HydrophobicContact CB-CD2 4.34Å
65	A	89.6	Confident	83.5	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	118.6	178.8	0	0	0	0	0	110.1	I86 C100	A65-I86 HydrophobicContact CB-CB 4.47Å; A65-I86 PolarHBondContact O-N 3.19Å; A65-C100 HydrophobicContact CB-CB 3.89Å
66	T	90	Very high	84.2	Confident	33 Å²	33	55.2 Å²	55.2	20%	0.202	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.6	-175.5	-54.7	0	0	0	0	109.9	L60 T61 P64 V68 D84 K85	L60-T66 CarbonylContact C-O 3.49Å; L60-T66 VanDerWaalsContact CA-O 3.31Å; L60-T66 WeakPolarHBondContact CA-O 3.37Å; T61-T66 PolarHBondContact N-O 3.36Å; T61-T66 PolarHBondContact O-N 3.42Å; P64-T66 PolarHBondContact O-N 2.91Å; P64-T66 VanDerWaalsContact O-N 3.16Å; P64-T66 PolarHBondContact O-OG1 2.84Å; P64-T66 VanDerWaalsContact O-OG1 3.05Å; T66-V68 PolarHBondContact O-N 3.37Å; T66-D84 WeakPolarHBondContact CA-O 3.49Å; T66-K85 HydrophobicContact CG2-CG 4.31Å
67	V	90	Very high	84.4	Confident	1 Å²	1	58 Å²	58	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.9	176.7	-179	0	0	0	0	109.7	I58 L60 L70 L80 G83 D84 I86	I58-V67 HydrophobicContact CG2-CG1 4.48Å; L60-V67 HydrophobicContact CD2-CB 4.37Å; L60-V67 HydrophobicContact CD2-CG2 3.74Å; V67-L70 HydrophobicContact CG1-CD1 4.12Å; V67-L70 HydrophobicContact CG1-CD2 3.57Å; V67-L70 HydrophobicContact CG1-CG 3.66Å; V67-L80 HydrophobicContact CG2-CD1 4.4Å; V67-G83 PolarHBondContact O-N 3.21Å; V67-D84 HydrophobicContact CG2-CB 4.33Å; V67-D84 PolarHBondContact N-O 3.16Å; V67-I86 HydrophobicContact CG2-CD1 4.42Å
68	V	89.5	Confident	84.4	Confident	69 Å²	69	68 Å²	68	42%	0.418	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-35.9	-179.7	-173.9	0	0	0	0	111.9	K59 T61 T66 I82	K59-V68 PolarHBondContact O-N 2.68Å; T61-V68 HydrophobicContact CG2-CG2 3.17Å; T66-V68 PolarHBondContact O-N 3.37Å; V68-I82 WeakPolarHBondContact O-CG2 3.36Å
69	A	86.1	Confident	84.2	Confident	39 Å²	39	68.5 Å²	68.5	32%	0.322	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	147.1	177.5	0	0	0	0	0	110	K59	K59-A69 HydrophobicContact CB-CB 3.88Å; K59-A69 HydrophobicContact CD-CB 4.41Å; K59-A69 PolarHBondContact N-O 3.35Å; K59-A69 PolarHBondContact O-N 3.49Å
70	L	86.7	Confident	84.1	Confident	29 Å²	29	62 Å²	62	15%	0.152	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138	174.1	-65.7	174.4	0	0	0	107.9	G57 I58 V67 W76 L80	G57-L70 CarbonylContact O-C 3.58Å; G57-L70 WeakPolarHBondContact O-CA 3.38Å; I58-L70 HydrophobicContact CB-CD2 4.3Å; I58-L70 HydrophobicContact CG1-CD2 3.84Å; I58-L70 HydrophobicContact CG2-CD2 4.06Å; V67-L70 HydrophobicContact CG1-CD1 4.12Å; V67-L70 HydrophobicContact CG1-CD2 3.57Å; V67-L70 HydrophobicContact CG1-CG 3.66Å; L70-W76 HydrophobicContact CD2-CB 3.89Å; L70-L80 HydrophobicContact CD1-CB 3.99Å; L70-L80 WeakPolarHBondContact CD1-O 3.35Å; L70-L80 HydrophobicContact CD2-CB 4.35Å
71	D	83.1	Confident	84	Confident	83 Å²	83	68.5 Å²	68.5	44%	0.444	37%	0.371	S	S	.	.			trans	-97.1	119.3	171.2	-176.7	-12	0	0	0	108.4	G57 G73 Y74	G57-D71 VanDerWaalsContact CA-CB 3.45Å; G57-D71 PolarHBondContact O-N 3.23Å; D71-G73 PolarHBondContact O-N 3.45Å; D71-G73 PolarHBondContact OD1-N 2.9Å; D71-Y74 HydrophobicContact CB-CD2 3.87Å; D71-Y74 HydrophobicContact CB-CE2 4.36Å; D71-Y74 PolarHBondContact O-N 2.99Å; D71-Y74 VanDerWaalsContact O-N 3.16Å; D71-Y74 WeakPolarHBondContact OD2-CE2 3.4Å
72	E	78.1	Confident	83.9	Confident	156 Å²	156	70.3 Å²	70.3	73%	0.729	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-60.4	-28.2	-175.6	-56.8	-176	170.1	0	0	112.1	Y74 G75 D77	E72-Y74 PolarHBondContact O-N 3.35Å; E72-Y74 VanDerWaalsContact O-N 3.09Å; E72-G75 PolarHBondContact O-N 2.94Å; E72-G75 VanDerWaalsContact O-N 3.13Å; E72-D77 VanDerWaalsContact CA-OD2 3.3Å; E72-D77 WeakPolarHBondContact CA-OD2 3.29Å
73	G	77	Confident	84	Confident	72 Å²	72	69.3 Å²	69.3	74%	0.742	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-62	-19.9	179.3	0	0	0	0	0	114.2	D71	D71-G73 PolarHBondContact O-N 3.45Å; D71-G73 PolarHBondContact OD1-N 2.9Å
74	Y	75.4	Confident	84.1	Confident	107 Å²	107	62.2 Å²	62.2	42%	0.42	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-96.9	-5.6	-178.7	-70.5	-95.7	0	0	0	113.8	G56 G57 D71 E72 W76	G56-Y74 WeakPolarHBondContact O-CD1 3.33Å; G57-Y74 VanDerWaalsContact CA-CD2 3.49Å; D71-Y74 HydrophobicContact CB-CD2 3.87Å; D71-Y74 HydrophobicContact CB-CE2 4.36Å; D71-Y74 PolarHBondContact O-N 2.99Å; D71-Y74 VanDerWaalsContact O-N 3.16Å; D71-Y74 WeakPolarHBondContact OD2-CE2 3.4Å; E72-Y74 PolarHBondContact O-N 3.35Å; E72-Y74 VanDerWaalsContact O-N 3.09Å; Y74-W76 VanDerWaalsContact C-N 3.35Å; Y74-W76 VanDerWaalsContact CB-CD1 3.46Å; Y74-W76 PolarHBondContact O-N 3.11Å
75	G	77.7	Confident	84.4	Confident	31 Å²	31	63.1 Å²	63.1	32%	0.32	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	18.2	174.8	0	0	0	0	0	115.2	E72 D77	E72-G75 PolarHBondContact O-N 2.94Å; E72-G75 VanDerWaalsContact O-N 3.13Å; G75-D77 VanDerWaalsContact C-N 3.31Å; G75-D77 PolarHBondContact O-N 3.13Å
76	W	82.5	Confident	84.4	Confident	6 Å²	6	63.1 Å²	63.1	2%	0.023	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-72.5	-20.7	-179.8	-68.9	113.9	0	0	0	114	K49 V55 G56 I58 L70 Y74 R78 S79 L80 M104 F110	K49-W76 HydrophobicContact CB-CH2 4.35Å; K49-W76 HydrophobicContact CD-CH2 4.23Å; K49-W76 HydrophobicContact CG-CH2 3.68Å; K49-W76 HydrophobicContact CG-CZ2 4.27Å; K49-W76 HydrophobicContact CG-CZ3 4.37Å; V55-W76 HydrophobicContact CG1-CZ2 3.99Å; G56-W76 PolarHBondContact O-NE1 3.13Å; I58-W76 HydrophobicContact CD1-CD2 3.47Å; I58-W76 VanDerWaalsContact CD1-CD2 3.47Å; I58-W76 HydrophobicContact CD1-CE3 3.85Å; I58-W76 HydrophobicContact CD1-CG 3.85Å; I58-W76 HydrophobicContact CD1-CH2 4.03Å; I58-W76 HydrophobicContact CD1-CZ2 3.67Å; I58-W76 HydrophobicContact CD1-CZ3 4.12Å; I58-W76 HydrophobicContact CG1-CB 4.48Å; I58-W76 VanDerWaalsContact CG1-CD1 3.44Å; I58-W76 HydrophobicContact CG1-CD2 3.88Å; I58-W76 HydrophobicContact CG1-CG 3.72Å; I58-W76 HydrophobicContact CG1-CZ2 4.41Å; L70-W76 HydrophobicContact CD2-CB 3.89Å; Y74-W76 VanDerWaalsContact C-N 3.35Å; Y74-W76 VanDerWaalsContact CB-CD1 3.46Å; Y74-W76 PolarHBondContact O-N 3.11Å; W76-R78 PolarHBondContact O-N 3.05Å; W76-R78 VanDerWaalsContact O-N 3.1Å; W76-S79 CarbonylContact O-C 3.59Å; W76-S79 WeakPolarHBondContact O-CA 3.32Å; W76-S79 WeakPolarHBondContact O-CB 3.5Å; W76-S79 PolarHBondContact O-N 2.92Å; W76-L80 HydrophobicContact CE3-CD1 4Å; W76-L80 HydrophobicContact CZ3-CD1 4.46Å; W76-L80 PolarHBondContact O-N 2.96Å; W76-M104 HydrophobicContact CH2-CE 3.99Å; W76-M104 HydrophobicContact CZ3-CE 4.38Å; W76-F110 AromaticContact CH2-CZ 3.95Å; W76-F110 HydrophobicContact CH2-CZ 3.95Å
77	D	77.3	Confident	84.3	Confident	74 Å²	74	63.9 Å²	63.9	40%	0.396	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-63.9	-21.1	-174.5	-51	-50.4	0	0	0	113.6	E72 G75 S79	E72-D77 VanDerWaalsContact CA-OD2 3.3Å; E72-D77 WeakPolarHBondContact CA-OD2 3.29Å; G75-D77 VanDerWaalsContact C-N 3.31Å; G75-D77 PolarHBondContact O-N 3.13Å; D77-S79 PolarHBondContact O-N 2.87Å
78	R	79	Confident	84.2	Confident	231 Å²	231	64.2 Å²	64.2	87%	0.872	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-71.8	-22.8	173.4	-61.6	-174.4	-178.1	-167.6	1	112.5	W76	W76-R78 PolarHBondContact O-N 3.05Å; W76-R78 VanDerWaalsContact O-N 3.1Å
79	S	82.6	Confident	84	Confident	23 Å²	23	61 Å²	61	16%	0.161	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-42.2	-162.5	-81.5	0	0	0	0	112.6	V47 W76 D77	V47-S79 WeakPolarHBondContact CG1-OG 3.32Å; W76-S79 CarbonylContact O-C 3.59Å; W76-S79 WeakPolarHBondContact O-CA 3.32Å; W76-S79 WeakPolarHBondContact O-CB 3.5Å; W76-S79 PolarHBondContact O-N 2.92Å; D77-S79 PolarHBondContact O-N 2.87Å
80	L	86.6	Confident	83.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.319	C	S	.	.			trans	-123.1	157	-177.4	-66.5	174.4	0	0	0	110.2	I58 V67 L70 W76 L112 I114	I58-L80 HydrophobicContact CD1-CD1 3.68Å; V67-L80 HydrophobicContact CG2-CD1 4.4Å; L70-L80 HydrophobicContact CD1-CB 3.99Å; L70-L80 WeakPolarHBondContact CD1-O 3.35Å; L70-L80 HydrophobicContact CD2-CB 4.35Å; W76-L80 HydrophobicContact CE3-CD1 4Å; W76-L80 HydrophobicContact CZ3-CD1 4.46Å; W76-L80 PolarHBondContact O-N 2.96Å; L80-L112 HydrophobicContact CD1-CD1 4.16Å; L80-L112 HydrophobicContact CD2-CD1 3.88Å; L80-L112 HydrophobicContact CG-CD1 4.33Å; L80-I114 HydrophobicContact CD2-CD1 4.22Å; L80-I114 HydrophobicContact CD2-CG2 3.86Å
81	R	86.1	Confident	83.8	Confident	154 Å²	154	73.1 Å²	73.1	58%	0.581	36%	0.356	S	S	*	.			trans	-128.6	155.6	170.3	-65.5	-175.9	-178.4	-178.5	-3.3	110.1	G83 D84	R81-G83 PolarHBondContact O-N 3.22Å; R81-D84 PolarHBondContact N-OD2 3.11Å; R81-D84 VanDerWaalsContact O-CB 3.3Å; R81-D84 WeakPolarHBondContact O-CB 3.25Å; R81-D84 PolarHBondContact O-N 3.05Å
82	I	88.4	Confident	84	Confident	120 Å²	120	74 Å²	74	62%	0.615	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	131.6	168.7	-60.4	173.2	0	0	0	108.7	V68	V68-I82 WeakPolarHBondContact O-CG2 3.36Å
83	G	88.2	Confident	84.4	Confident	20 Å²	20	76 Å²	76	21%	0.206	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-13.7	-175.3	0	0	0	0	0	115.1	V67 R81 K85 P117	V67-G83 PolarHBondContact O-N 3.21Å; R81-G83 PolarHBondContact O-N 3.22Å; G83-K85 PolarHBondContact O-N 3.36Å; G83-P117 WeakPolarHBondContact O-CD 3.42Å; G83-P117 VanDerWaalsContact O-CG 3.3Å; G83-P117 WeakPolarHBondContact O-CG 3.36Å
84	D	88.4	Confident	85	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	33%	0.326	C	S	.	.			trans	-60.9	130.4	176.9	-76.5	-16.3	0	0	0	110.1	T66 V67 R81 R116	T66-D84 WeakPolarHBondContact CA-O 3.49Å; V67-D84 HydrophobicContact CG2-CB 4.33Å; V67-D84 PolarHBondContact N-O 3.16Å; R81-D84 PolarHBondContact N-OD2 3.11Å; R81-D84 VanDerWaalsContact O-CB 3.3Å; R81-D84 WeakPolarHBondContact O-CB 3.25Å; R81-D84 PolarHBondContact O-N 3.05Å; D84-R116 WeakPolarHBondContact OD1-CA 3.38Å; D84-R116 WeakPolarHBondContact OD1-CB 3.43Å; D84-R116 VanDerWaalsContact OD1-CG 3.23Å; D84-R116 WeakPolarHBondContact OD1-CG 3.38Å; D84-R116 IonicContact OD1-CZ 3.81Å; D84-R116 IonicContact OD1-NE 2.91Å; D84-R116 PolarHBondContact OD1-NE 3.13Å; D84-R116 IonicContact OD1-NH2 3.8Å; D84-R116 IonicContact OD2-CZ 3.65Å; D84-R116 IonicContact OD2-NE 3.5Å; D84-R116 IonicContact OD2-NH2 2.92Å; D84-R116 PolarHBondContact OD2-NH2 3.45Å
85	K	90	Very high	85.6	Confident	74 Å²	74	75.2 Å²	75.2	32%	0.322	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.3	176.7	-63.3	178.4	180	177.3	0	109.8	P64 T66 G83 L87 I114 E115	P64-K85 HydrophobicContact CG-CB 4.39Å; P64-K85 HydrophobicContact CG-CD 4.06Å; P64-K85 HydrophobicContact CG-CG 4.44Å; T66-K85 HydrophobicContact CG2-CG 4.31Å; G83-K85 PolarHBondContact O-N 3.36Å; K85-L87 PolarHBondContact O-N 2.96Å; K85-I114 CarbonylContact O-C 3.53Å; K85-I114 VanDerWaalsContact O-CA 3.24Å; K85-I114 WeakPolarHBondContact O-CA 3.41Å; K85-E115 HydrophobicContact CB-CB 4.29Å; K85-E115 PolarHBondContact N-O 3.43Å; K85-E115 PolarHBondContact O-N 3.3Å
86	I	88.9	Confident	86.1	Confident	2 Å²	2	76.1 Å²	76.1	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	109.9	177.4	-55.4	175.2	0	0	0	108.5	L60 A65 V67 I89 P94 M104 L112 I114	L60-I86 HydrophobicContact CD1-CD1 4.04Å; L60-I86 HydrophobicContact CD2-CD1 3.72Å; A65-I86 HydrophobicContact CB-CB 4.47Å; A65-I86 PolarHBondContact O-N 3.19Å; V67-I86 HydrophobicContact CG2-CD1 4.42Å; I86-I89 HydrophobicContact CG2-CG1 4.05Å; I86-P94 HydrophobicContact CG2-CG 4.3Å; I86-M104 HydrophobicContact CD1-SD 4.35Å; I86-L112 HydrophobicContact CG2-CD2 4.34Å; I86-I114 HydrophobicContact CG1-CG2 4.3Å
87	L	88.2	Confident	86.3	Confident	49 Å²	49	76.7 Å²	76.7	26%	0.257	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-24.7	179.5	-59	-174.9	0	0	0	112.4	P64 K85 R93 V113 E115	P64-L87 HydrophobicContact CB-CD2 4.34Å; K85-L87 PolarHBondContact O-N 2.96Å; L87-R93 WeakPolarHBondContact O-CG 3.48Å; L87-V113 HydrophobicContact CB-CG1 4.27Å; L87-V113 PolarHBondContact N-O 3.29Å; L87-E115 HydrophobicContact CD1-CB 3.79Å; L87-E115 HydrophobicContact CG-CB 4.09Å
88	G	87.8	Confident	86.8	Confident	8 Å²	8	79.9 Å²	79.9	8%	0.082	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	151.3	-177.7	0	0	0	0	0	112.7	K92 V113	G88-K92 WeakPolarHBondContact CA-O 3.24Å; G88-V113 PolarHBondContact N-O 3.48Å; G88-V113 PolarHBondContact O-N 3.26Å
89	I	86.8	Confident	87.3	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	118.5	170.2	-56.7	163.1	0	0	0	105.8	I86 R91 K92 C100 L103 M104 F110 K111 L112	I86-I89 HydrophobicContact CG2-CG1 4.05Å; I89-R91 PolarHBondContact O-N 3.35Å; I89-K92 PolarHBondContact N-O 3.31Å; I89-K92 PolarHBondContact O-N 3.36Å; I89-K92 VanDerWaalsContact O-O 3.07Å; I89-C100 HydrophobicContact CD1-CB 4.43Å; I89-C100 WeakPolarHBondContact CD1-O 3.48Å; I89-C100 VanDerWaalsContact CD1-SG 3.55Å; I89-L103 HydrophobicContact CB-CB 4.38Å; I89-L103 HydrophobicContact CD1-CB 3.57Å; I89-L103 HydrophobicContact CD1-CD1 4.16Å; I89-L103 HydrophobicContact CG2-CB 4.41Å; I89-M104 HydrophobicContact CD1-CG 3.5Å; I89-M104 HydrophobicContact CD1-SD 4.4Å; I89-M104 HydrophobicContact CG1-CG 4.25Å; I89-F110 HydrophobicContact CG2-CB 3.96Å; I89-F110 HydrophobicContact CG2-CD2 3.94Å; I89-F110 HydrophobicContact CG2-CG 3.99Å; I89-K111 CarbonylContact C-O 3.57Å; I89-K111 WeakPolarHBondContact CA-O 3.47Å; I89-L112 HydrophobicContact CB-CD2 4.41Å; I89-L112 HydrophobicContact CG1-CD2 3.68Å; I89-L112 HydrophobicContact CG2-CD2 4.35Å
90	E	83.1	Confident	87.6	Confident	76 Å²	76	70.5 Å²	70.5	36%	0.355	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	-117.6	-168.8	-71.5	-62.8	157.2	0	0	111.8	F110 K111	E90-F110 HydrophobicContact CG-CB 4.02Å; E90-F110 WeakPolarHBondContact OE1-CA 3.14Å; E90-K111 PolarHBondContact N-O 2.85Å; E90-K111 PolarHBondContact OE1-N 2.97Å
91	R	84.4	Confident	87.6	Confident	247 Å²	247	73.8 Å²	73.8	93%	0.932	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	9.8	177.9	-58.5	-177.4	-177.5	179	0.3	112.2	I89	I89-R91 PolarHBondContact O-N 3.35Å
92	K	86.9	Confident	87.6	Confident	100 Å²	100	70.9 Å²	70.9	44%	0.435	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-113.1	138.2	-176.3	-66.9	-178.9	179	174.1	0	110.6	G88 I89 L103	G88-K92 WeakPolarHBondContact CA-O 3.24Å; I89-K92 PolarHBondContact N-O 3.31Å; I89-K92 PolarHBondContact O-N 3.36Å; I89-K92 VanDerWaalsContact O-O 3.07Å; K92-L103 HydrophobicContact CB-CD1 4.23Å; K92-L103 HydrophobicContact CB-CD2 4.42Å; K92-L103 HydrophobicContact CD-CD2 3.63Å
93	R	87.8	Confident	87.6	Confident	199 Å²	199	65.2 Å²	65.2	75%	0.751	30%	0.3	S	S	*	.			trans	-93.5	119.2	173.2	-179	168.6	-176.4	179.2	1.5	109.2	L87	L87-R93 WeakPolarHBondContact O-CG 3.48Å
94	P	89	Confident	87.5	Confident	13 Å²	13	64.3 Å²	64.3	8%	0.084	29%	0.29	C	S	.	.			trans	-65.6	140	175	27.1	-32.2	0	0	0	110.1	I86 C100 L103	I86-P94 HydrophobicContact CG2-CG 4.3Å; P94-C100 HydrophobicContact CB-CB 3.81Å; P94-C100 HydrophobicContact CG-CB 4.4Å; P94-L103 HydrophobicContact CB-CD1 4.22Å
95	Q	87.4	Confident	87.3	Confident	149 Å²	149	68.1 Å²	68.1	70%	0.696	31%	0.31	S	S	*	.	S	Bend	trans	-83.1	-39.4	177.8	-69.7	-179.9	-8.1	0	0	111.4	Q63 H99	Q63-Q95 WeakPolarHBondContact CG-O 3.43Å; Q63-Q95 PolarHBondContact NE2-O 2.78Å; Q95-H99 PolarHBondContact N-ND1 3.49Å
96	D	87.9	Confident	87	Confident	51 Å²	51	69.5 Å²	69.5	27%	0.273	32%	0.318	S	S	.	.	S	Bend	trans	-145.7	178	-178.5	63.7	7.1	0	0	0	111	Q63 Q98 H99 C100	Q63-D96 HydrophobicContact CG-CB 4.25Å; D96-Q98 VanDerWaalsContact C-N 3.32Å; D96-Q98 PolarHBondContact O-N 3.08Å; D96-Q98 PolarHBondContact OD1-N 2.93Å; D96-H99 WeakPolarHBondContact OD1-CA 3.31Å; D96-H99 WeakPolarHBondContact OD1-CB 3.12Å; D96-H99 PolarHBondContact OD1-N 3.09Å; D96-C100 WeakPolarHBondContact O-CB 3.16Å; D96-C100 PolarHBondContact O-N 3.46Å
97	A	88.1	Confident	86.3	Confident	17 Å²	17	73.2 Å²	73.2	14%	0.14	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-36.2	178.1	0	0	0	0	0	113.1	L60 C100 Q101	L60-A97 HydrophobicContact CB-CB 3.83Å; A97-C100 WeakPolarHBondContact O-CB 3.41Å; A97-C100 PolarHBondContact O-N 2.82Å; A97-Q101 PolarHBondContact O-N 2.87Å; A97-Q101 VanDerWaalsContact O-N 3.13Å
98	Q	87.5	Confident	85.4	Confident	141 Å²	141	75.5 Å²	75.5	66%	0.659	35%	0.35	S	S	*	.	H	α-helix	trans	-71.6	-46.3	-179.6	-69.1	-165.9	-23.1	0	0	111.8	D96 C100 Q101 I102	D96-Q98 VanDerWaalsContact C-N 3.32Å; D96-Q98 PolarHBondContact O-N 3.08Å; D96-Q98 PolarHBondContact OD1-N 2.93Å; Q98-C100 PolarHBondContact O-N 2.77Å; Q98-Q101 WeakPolarHBondContact O-CB 3.39Å; Q98-Q101 PolarHBondContact O-N 3.35Å; Q98-Q101 VanDerWaalsContact O-N 3.11Å; Q98-I102 WeakPolarHBondContact O-CG1 3.31Å; Q98-I102 PolarHBondContact O-N 3.22Å
99	H	89.4	Confident	84.8	Confident	57 Å²	57	79.2 Å²	79.2	26%	0.264	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-35.9	173.7	-173	-169.2	0	0	0	111	Q95 D96 I102 L103	Q95-H99 PolarHBondContact N-ND1 3.49Å; D96-H99 WeakPolarHBondContact OD1-CA 3.31Å; D96-H99 WeakPolarHBondContact OD1-CB 3.12Å; D96-H99 PolarHBondContact OD1-N 3.09Å; H99-I102 PolarHBondContact O-N 3.47Å; H99-L103 WeakPolarHBondContact O-CB 3.29Å; H99-L103 VanDerWaalsContact O-CG 3.29Å; H99-L103 WeakPolarHBondContact O-CG 3.23Å; H99-L103 PolarHBondContact O-N 3Å
100	C	88.8	Confident	84.5	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-58	-49.6	171.5	-165.4	0	0	0	0	111.5	L60 A65 I89 P94 D96 A97 Q98 I102 L103 M104	L60-C100 HydrophobicContact CD1-CB 3.74Å; L60-C100 WeakPolarHBondContact CD1-SG 3.11Å; A65-C100 HydrophobicContact CB-CB 3.89Å; I89-C100 HydrophobicContact CD1-CB 4.43Å; I89-C100 WeakPolarHBondContact CD1-O 3.48Å; I89-C100 VanDerWaalsContact CD1-SG 3.55Å; P94-C100 HydrophobicContact CB-CB 3.81Å; P94-C100 HydrophobicContact CG-CB 4.4Å; D96-C100 WeakPolarHBondContact O-CB 3.16Å; D96-C100 PolarHBondContact O-N 3.46Å; A97-C100 WeakPolarHBondContact O-CB 3.41Å; A97-C100 PolarHBondContact O-N 2.82Å; Q98-C100 PolarHBondContact O-N 2.77Å; C100-I102 PolarHBondContact O-N 2.75Å; C100-L103 PolarHBondContact O-N 2.82Å; C100-M104 VanDerWaalsContact O-CG 3.25Å; C100-M104 WeakPolarHBondContact O-CG 3.3Å; C100-M104 PolarHBondContact O-N 2.9Å
101	Q	86.2	Confident	84.5	Confident	71 Å²	71	80.8 Å²	80.8	33%	0.332	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-41.8	176.7	-70.4	177.3	-10.2	0	0	112.4	L60 A97 Q98 L103 M104 N105	L60-Q101 HydrophobicContact CD1-CG 4.15Å; A97-Q101 PolarHBondContact O-N 2.87Å; A97-Q101 VanDerWaalsContact O-N 3.13Å; Q98-Q101 WeakPolarHBondContact O-CB 3.39Å; Q98-Q101 PolarHBondContact O-N 3.35Å; Q98-Q101 VanDerWaalsContact O-N 3.11Å; Q101-L103 PolarHBondContact O-N 3.45Å; Q101-M104 PolarHBondContact O-N 2.83Å; Q101-N105 WeakPolarHBondContact O-CB 3.39Å; Q101-N105 VanDerWaalsContact O-CG 3.26Å; Q101-N105 PolarHBondContact O-N 3.4Å; Q101-N105 PolarHBondContact O-ND2 2.9Å
102	I	87.1	Confident	84.6	Confident	92 Å²	92	69 Å²	69	47%	0.472	33%	0.332	S	S	.	.	H	α-helix	trans	-59.4	-48.1	176.2	-67.1	166.6	0	0	0	110.5	Q98 H99 C100 M104 N105 Q106	Q98-I102 WeakPolarHBondContact O-CG1 3.31Å; Q98-I102 PolarHBondContact O-N 3.22Å; H99-I102 PolarHBondContact O-N 3.47Å; C100-I102 PolarHBondContact O-N 2.75Å; I102-M104 PolarHBondContact O-N 2.65Å; I102-N105 PolarHBondContact O-N 2.86Å; I102-Q106 WeakPolarHBondContact O-CG 3.44Å; I102-Q106 PolarHBondContact O-N 2.8Å; I102-Q106 VanDerWaalsContact O-N 3.08Å
103	L	87.7	Confident	84.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-41.4	179	-73.6	173.3	0	0	0	112.2	I89 K92 P94 H99 C100 Q101 N105 Q106 Y107	I89-L103 HydrophobicContact CB-CB 4.38Å; I89-L103 HydrophobicContact CD1-CB 3.57Å; I89-L103 HydrophobicContact CD1-CD1 4.16Å; I89-L103 HydrophobicContact CG2-CB 4.41Å; K92-L103 HydrophobicContact CB-CD1 4.23Å; K92-L103 HydrophobicContact CB-CD2 4.42Å; K92-L103 HydrophobicContact CD-CD2 3.63Å; P94-L103 HydrophobicContact CB-CD1 4.22Å; H99-L103 WeakPolarHBondContact O-CB 3.29Å; H99-L103 VanDerWaalsContact O-CG 3.29Å; H99-L103 WeakPolarHBondContact O-CG 3.23Å; H99-L103 PolarHBondContact O-N 3Å; C100-L103 PolarHBondContact O-N 2.82Å; Q101-L103 PolarHBondContact O-N 3.45Å; L103-N105 VanDerWaalsContact C-N 3.27Å; L103-N105 PolarHBondContact O-N 3.46Å; L103-Q106 PolarHBondContact O-N 2.77Å; L103-Y107 WeakPolarHBondContact O-CD2 3.13Å
104	M	85.6	Confident	84.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.4	-27.4	177	-63.7	173.1	76.4	0	0	112.2	V55 I58 L60 W76 I86 I89 C100 Q101 I102 F110 L112	V55-M104 HydrophobicContact CB-CB 4.2Å; V55-M104 HydrophobicContact CG1-CB 4.12Å; V55-M104 HydrophobicContact CG1-CE 3.68Å; V55-M104 HydrophobicContact CG1-SD 4.07Å; V55-M104 VanDerWaalsContact CG2-C 3.42Å; V55-M104 HydrophobicContact CG2-CB 3.35Å; V55-M104 VanDerWaalsContact CG2-O 3.31Å; V55-M104 WeakPolarHBondContact CG2-O 3.4Å; I58-M104 HydrophobicContact CD1-CE 3.61Å; L60-M104 HydrophobicContact CD1-SD 4.44Å; W76-M104 HydrophobicContact CH2-CE 3.99Å; W76-M104 HydrophobicContact CZ3-CE 4.38Å; I86-M104 HydrophobicContact CD1-SD 4.35Å; I89-M104 HydrophobicContact CD1-CG 3.5Å; I89-M104 HydrophobicContact CD1-SD 4.4Å; I89-M104 HydrophobicContact CG1-CG 4.25Å; C100-M104 VanDerWaalsContact O-CG 3.25Å; C100-M104 WeakPolarHBondContact O-CG 3.3Å; C100-M104 PolarHBondContact O-N 2.9Å; Q101-M104 PolarHBondContact O-N 2.83Å; I102-M104 PolarHBondContact O-N 2.65Å; M104-F110 HydrophobicContact CB-CE1 3.77Å; M104-F110 HydrophobicContact CB-CE2 4.43Å; M104-F110 HydrophobicContact CB-CZ 3.71Å; M104-F110 HydrophobicContact CE-CE2 3.82Å; M104-F110 HydrophobicContact CE-CZ 3.51Å; M104-F110 HydrophobicContact CG-CE1 4.25Å; M104-F110 HydrophobicContact CG-CE2 4.04Å; M104-F110 HydrophobicContact CG-CZ 3.77Å; M104-F110 WeakPolarHBondContact O-CE1 3.47Å; M104-L112 HydrophobicContact CE-CD1 4.36Å; M104-L112 HydrophobicContact CE-CD2 4.45Å
105	N	84.2	Confident	84.4	Confident	81 Å²	81	59.9 Å²	59.9	43%	0.433	30%	0.302	S	S	.	.	H	α-helix	trans	-79.9	-24	176.8	-76.4	-27.7	0	0	0	113.3	V55 Q101 I102 L103 Y107	V55-N105 VanDerWaalsContact CB-OD1 3.29Å; V55-N105 WeakPolarHBondContact CB-OD1 3.3Å; V55-N105 WeakPolarHBondContact CG2-OD1 3.37Å; V55-N105 PolarHBondContact N-OD1 2.73Å; Q101-N105 WeakPolarHBondContact O-CB 3.39Å; Q101-N105 VanDerWaalsContact O-CG 3.26Å; Q101-N105 PolarHBondContact O-N 3.4Å; Q101-N105 PolarHBondContact O-ND2 2.9Å; I102-N105 PolarHBondContact O-N 2.86Å; L103-N105 VanDerWaalsContact C-N 3.27Å; L103-N105 PolarHBondContact O-N 3.46Å; N105-Y107 VanDerWaalsContact C-N 3.32Å
106	Q	84	Confident	84.3	Confident	104 Å²	104	55.9 Å²	55.9	49%	0.486	28%	0.28	S	S	.	.	H	α-helix	trans	-69.7	-29.2	179.7	-78.3	173.6	9.8	0	0	113.3	I102 L103	I102-Q106 WeakPolarHBondContact O-CG 3.44Å; I102-Q106 PolarHBondContact O-N 2.8Å; I102-Q106 VanDerWaalsContact O-N 3.08Å; L103-Q106 PolarHBondContact O-N 2.77Å
107	Y	73.8	Confident	83.8	Confident	80 Å²	80	56.2 Å²	56.2	31%	0.314	29%	0.285	S	S	.	.			trans	-117.2	125.6	-173.3	-57.2	-72.6	0	0	0	110.2	L103 N105 T109 F110	L103-Y107 WeakPolarHBondContact O-CD2 3.13Å; N105-Y107 VanDerWaalsContact C-N 3.32Å; Y107-T109 PolarHBondContact O-N 2.7Å; Y107-F110 WeakPolarHBondContact O-CD1 3.49Å
108	P	69.8	Low	82.9	Confident	96 Å²	96	60.1 Å²	60.1	62%	0.623	30%	0.303	S	S	*	.	S	Bend	trans	-66.1	-30.3	175.7	25.8	-32.7	0	0	0	111.7	K49	K49-P108 WeakPolarHBondContact CD-O 3.3Å
109	T	74.7	Confident	81.6	Confident	86 Å²	86	57.2 Å²	57.2	53%	0.528	30%	0.303	S	S	.	.	S	Bend	trans	-132.5	130.4	171.1	-50.2	0	0	0	0	107.5	Y107	Y107-T109 PolarHBondContact O-N 2.7Å
110	F	80.7	Confident	79.8	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.326	C	S	.	.			trans	-142.5	155.6	177	51.8	-97.3	0	0	0	110.3	K49 W76 I89 E90 M104 Y107 L112	K49-F110 HydrophobicContact CB-CE1 4.18Å; K49-F110 HydrophobicContact CB-CZ 4.26Å; K49-F110 HydrophobicContact CD-CE1 3.72Å; K49-F110 HydrophobicContact CD-CZ 4.22Å; K49-F110 HydrophobicContact CG-CE1 4.39Å; K49-F110 HydrophobicContact CG-CZ 4.49Å; W76-F110 AromaticContact CH2-CZ 3.95Å; W76-F110 HydrophobicContact CH2-CZ 3.95Å; I89-F110 HydrophobicContact CG2-CB 3.96Å; I89-F110 HydrophobicContact CG2-CD2 3.94Å; I89-F110 HydrophobicContact CG2-CG 3.99Å; E90-F110 HydrophobicContact CG-CB 4.02Å; E90-F110 WeakPolarHBondContact OE1-CA 3.14Å; M104-F110 HydrophobicContact CB-CE1 3.77Å; M104-F110 HydrophobicContact CB-CE2 4.43Å; M104-F110 HydrophobicContact CB-CZ 3.71Å; M104-F110 HydrophobicContact CE-CE2 3.82Å; M104-F110 HydrophobicContact CE-CZ 3.51Å; M104-F110 HydrophobicContact CG-CE1 4.25Å; M104-F110 HydrophobicContact CG-CE2 4.04Å; M104-F110 HydrophobicContact CG-CZ 3.77Å; M104-F110 WeakPolarHBondContact O-CE1 3.47Å; Y107-F110 WeakPolarHBondContact O-CD1 3.49Å; F110-L112 HydrophobicContact CD2-CD2 3.59Å; F110-L112 HydrophobicContact CD2-CG 3.79Å; F110-L112 HydrophobicContact CE2-CD1 3.95Å; F110-L112 HydrophobicContact CE2-CD2 3.41Å; F110-L112 VanDerWaalsContact CE2-CD2 3.41Å; F110-L112 HydrophobicContact CE2-CG 3.54Å
111	K	82.8	Confident	77.6	Confident	110 Å²	110	70.9 Å²	70.9	48%	0.478	37%	0.369	S	S	.	.			trans	-90.1	121	170.6	-63.2	-173.1	177.8	178.4	0	110.3	V46 I89 E90	V46-K111 HydrophobicContact CG1-CB 3.82Å; V46-K111 HydrophobicContact CG1-CD 3.85Å; V46-K111 HydrophobicContact CG1-CG 3.57Å; I89-K111 CarbonylContact C-O 3.57Å; I89-K111 WeakPolarHBondContact CA-O 3.47Å; E90-K111 PolarHBondContact N-O 2.85Å; E90-K111 PolarHBondContact OE1-N 2.97Å
112	L	86.9	Confident	75.3	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	150	166.8	-61.9	177.8	0	0	0	111.4	K45 V46 V47 L80 I86 I89 M104 F110 I114	K45-L112 CarbonylContact C-O 3.59Å; K45-L112 CarbonylContact O-C 3.56Å; V46-L112 WeakPolarHBondContact CA-O 3.34Å; V47-L112 HydrophobicContact CB-CB 4Å; V47-L112 HydrophobicContact CB-CD1 4.01Å; V47-L112 HydrophobicContact CB-CG 4.2Å; V47-L112 HydrophobicContact CG1-CD1 4.11Å; V47-L112 HydrophobicContact CG2-CB 4.35Å; V47-L112 HydrophobicContact CG2-CD1 4.46Å; L80-L112 HydrophobicContact CD1-CD1 4.16Å; L80-L112 HydrophobicContact CD2-CD1 3.88Å; L80-L112 HydrophobicContact CG-CD1 4.33Å; I86-L112 HydrophobicContact CG2-CD2 4.34Å; I89-L112 HydrophobicContact CB-CD2 4.41Å; I89-L112 HydrophobicContact CG1-CD2 3.68Å; I89-L112 HydrophobicContact CG2-CD2 4.35Å; M104-L112 HydrophobicContact CE-CD1 4.36Å; M104-L112 HydrophobicContact CE-CD2 4.45Å; F110-L112 HydrophobicContact CD2-CD2 3.59Å; F110-L112 HydrophobicContact CD2-CG 3.79Å; F110-L112 HydrophobicContact CE2-CD1 3.95Å; F110-L112 HydrophobicContact CE2-CD2 3.41Å; F110-L112 VanDerWaalsContact CE2-CD2 3.41Å; F110-L112 HydrophobicContact CE2-CG 3.54Å; L112-I114 HydrophobicContact CB-CG2 4.05Å
113	V	86.1	Confident	72.9	Confident	49 Å²	49	75.4 Å²	75.4	30%	0.297	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	107.2	162.7	-179.4	0	0	0	0	106.2	L87 G88	L87-V113 HydrophobicContact CB-CG1 4.27Å; L87-V113 PolarHBondContact N-O 3.29Å; G88-V113 PolarHBondContact N-O 3.48Å; G88-V113 PolarHBondContact O-N 3.26Å
114	I	88.8	Confident	70.4	Confident	2 Å²	2	79.4 Å²	79.4	1%	0.01	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	147	-178.6	61.8	173.9	0	0	0	111.6	K45 V47 L80 K85 I86 L112	K45-I114 HydrophobicContact CB-CD1 4.08Å; K45-I114 HydrophobicContact CB-CG1 3.93Å; V47-I114 HydrophobicContact CG2-CD1 4.32Å; L80-I114 HydrophobicContact CD2-CD1 4.22Å; L80-I114 HydrophobicContact CD2-CG2 3.86Å; K85-I114 CarbonylContact O-C 3.53Å; K85-I114 VanDerWaalsContact O-CA 3.24Å; K85-I114 WeakPolarHBondContact O-CA 3.41Å; I86-I114 HydrophobicContact CG1-CG2 4.3Å; L112-I114 HydrophobicContact CB-CG2 4.05Å
115	E	85.5	Confident	68.3	Low	70 Å²	70	85.2 Å²	85.2	33%	0.327	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	115.1	164.8	179.1	-169.1	156.8	0	0	107.8	P42 K85 L87	P42-E115 HydrophobicContact CB-CG 4.21Å; K85-E115 HydrophobicContact CB-CB 4.29Å; K85-E115 PolarHBondContact N-O 3.43Å; K85-E115 PolarHBondContact O-N 3.3Å; L87-E115 HydrophobicContact CD1-CB 3.79Å; L87-E115 HydrophobicContact CG-CB 4.09Å
116	R	84.2	Confident	66.2	Low	64 Å²	64	89.8 Å²	89.8	24%	0.242	50%	0.496	C	S	.	.			trans	-83.9	126.1	177.1	-177	158.6	-66.7	167.6	3.3	109.2	D84 I118	D84-R116 WeakPolarHBondContact OD1-CA 3.38Å; D84-R116 WeakPolarHBondContact OD1-CB 3.43Å; D84-R116 VanDerWaalsContact OD1-CG 3.23Å; D84-R116 WeakPolarHBondContact OD1-CG 3.38Å; D84-R116 IonicContact OD1-CZ 3.81Å; D84-R116 IonicContact OD1-NE 2.91Å; D84-R116 PolarHBondContact OD1-NE 3.13Å; D84-R116 IonicContact OD1-NH2 3.8Å; D84-R116 IonicContact OD2-CZ 3.65Å; D84-R116 IonicContact OD2-NE 3.5Å; D84-R116 IonicContact OD2-NH2 2.92Å; D84-R116 PolarHBondContact OD2-NH2 3.45Å; R116-I118 PolarHBondContact O-N 3.19Å; R116-I118 VanDerWaalsContact O-N 3.1Å
117	P	77.8	Confident	64.6	Low	58 Å²	58	92.4 Å²	92.4	38%	0.377	51%	0.508	S	S	.	.			trans	-61.1	122.2	170.6	26.4	-33	0	0	0	107.2	G83 A119	G83-P117 WeakPolarHBondContact O-CD 3.42Å; G83-P117 VanDerWaalsContact O-CG 3.3Å; G83-P117 WeakPolarHBondContact O-CG 3.36Å; P117-A119 VanDerWaalsContact C-N 3.28Å; P117-A119 PolarHBondContact O-N 2.82Å
118	I	68.2	Low	63.4	Low	99 Å²	99	94.1 Å²	94.1	51%	0.508	53%	0.529	S	S	.	.			trans	-67.3	103.6	163.4	-62.4	165.3	0	0	0	103.1	K40 R116 K120	K40-I118 HydrophobicContact CB-CD1 4.18Å; K40-I118 HydrophobicContact CD-CD1 3.59Å; K40-I118 HydrophobicContact CG-CD1 3.71Å; R116-I118 PolarHBondContact O-N 3.19Å; R116-I118 VanDerWaalsContact O-N 3.1Å; I118-K120 VanDerWaalsContact C-N 3.32Å; I118-K120 PolarHBondContact O-N 2.79Å
119	A	60.2	Low	62.1	Low	81 Å²	81	98.1 Å²	98.1	67%	0.669	54%	0.54	S	S	*	.			trans	-47.9	110.8	165	0	0	0	0	0	104.7	P117 L121	P117-A119 VanDerWaalsContact C-N 3.28Å; P117-A119 PolarHBondContact O-N 2.82Å; A119-L121 VanDerWaalsContact C-N 3.28Å; A119-L121 PolarHBondContact O-N 2.9Å
120	K	53.2	Low	60.4	Low	171 Å²	171	98.7 Å²	98.7	74%	0.743	55%	0.546	S	S	*	.			trans	-56.7	113.4	160.8	-68.2	178.3	-178.4	177.7	0	101.4	I118 E122	I118-K120 VanDerWaalsContact C-N 3.32Å; I118-K120 PolarHBondContact O-N 2.79Å; K120-E122 PolarHBondContact O-N 3.06Å
121	L	41.2	Very low	58.4	Low	172 Å²	172	105.3 Å²	105.3	90%	0.901	58%	0.581	S	S	*	*			trans	-57	83.1	151.7	-111	91.8	0	0	0	103.4	A119 A123	A119-L121 VanDerWaalsContact C-N 3.28Å; A119-L121 PolarHBondContact O-N 2.9Å; L121-A123 PolarHBondContact O-N 2.99Å
122	E	38.5	Very low	56.7	Low	167 Å²	167	108 Å²	108	78%	0.78	60%	0.599	S	S	*	*			trans	-54.5	125	150.8	-80.5	-173.4	153.2	0	0	103.6	K120 A124	K120-E122 PolarHBondContact O-N 3.06Å; E122-A124 PolarHBondContact O-N 3.03Å
123	A	37.5	Very low	54.7	Low	91 Å²	91	111.4 Å²	111.4	75%	0.752	63%	0.627	S	S	*	*			trans	-37	127.1	172.6	0	0	0	0	0	108.4	L121 P125	L121-A123 PolarHBondContact O-N 2.99Å; A123-P125 VanDerWaalsContact O-N 3.13Å
124	A	35.4	Very low	52.8	Low	87 Å²	87	116.3 Å²	116.3	72%	0.719	65%	0.651	S	S	*	*			trans	-37.4	123.8	174.3	0	0	0	0	0	109.2	E122 M126	E122-A124 PolarHBondContact O-N 3.03Å; A124-M126 PolarHBondContact O-N 2.83Å; A124-M126 VanDerWaalsContact O-N 3.12Å
125	P	40.3	Very low	50.8	Low	121 Å²	121	124.3 Å²	124.3	79%	0.786	69%	0.693	S	S	*	*			trans	-56.3	123.1	150.4	26	-27.9	0	0	0	104.6	A123 E127	A123-P125 VanDerWaalsContact O-N 3.13Å; P125-E127 PolarHBondContact O-N 3.1Å
126	M	41	Very low	49.2	Very low	178 Å²	178	128.4 Å²	128.4	88%	0.877	71%	0.713	S	S	*	*			trans	-30.2	129.4	164.8	-101	168.7	56.1	0	0	108.9	A124	A124-M126 PolarHBondContact O-N 2.83Å; A124-M126 VanDerWaalsContact O-N 3.12Å
127	E	51.1	Low	47.2	Very low	159 Å²	159	133.2 Å²	133.2	74%	0.743	74%	0.742	S	S	*	*			trans	-44.7	134.3	173.9	-70	-167.9	151.6	0	0	109.1	P125 E129	P125-E127 PolarHBondContact O-N 3.1Å; E127-E129 PolarHBondContact O-N 2.91Å
128	P	47.4	Very low	45.5	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	77%	0.769	S	S	*	*			trans	-57.3	132.6	170.3	27.8	-31.4	0	0	0	106.4	C130	P128-C130 PolarHBondContact O-N 2.95Å
129	E	42.4	Very low	43.8	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	78%	0.777	S	S	*	*			trans	-17.1	101.5	170.7	-67.9	166.8	152.1	0	0	111.9	E127 D131	E127-E129 PolarHBondContact O-N 2.91Å; E129-D131 PolarHBondContact O-N 2.86Å
130	C	38.9	Very low	42.9	Very low	98 Å²	98	141.2 Å²	141.2	66%	0.662	79%	0.785	S	S	*	*			trans	-65.4	98.5	157.1	-79.5	0	0	0	0	105.3	P128 I132	P128-C130 PolarHBondContact O-N 2.95Å; C130-I132 WeakPolarHBondContact O-CG1 3.44Å; C130-I132 PolarHBondContact O-N 2.92Å
131	D	40	Very low	42	Very low	138 Å²	138	138.2 Å²	138.2	74%	0.738	79%	0.786	S	S	*	*			trans	-50.4	111.5	164	-86	-34.1	0	0	0	107.9	E129 A133	E129-D131 PolarHBondContact O-N 2.86Å; D131-A133 HydrophobicContact CB-CB 4.4Å; D131-A133 PolarHBondContact O-N 3.4Å
132	I	46.3	Very low	41.9	Very low	168 Å²	168	133.3 Å²	133.3	86%	0.862	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	31.1	177.1	-46.1	175	0	0	0	109.4	C130	C130-I132 WeakPolarHBondContact O-CG1 3.44Å; C130-I132 PolarHBondContact O-N 2.92Å
133	A	45.5	Very low	41.8	Very low	70 Å²	70	131 Å²	131	58%	0.579	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-13.2	-170.2	0	0	0	0	0	114.3	D131	D131-A133 HydrophobicContact CB-CB 4.4Å; D131-A133 PolarHBondContact O-N 3.4Å
134	D	45.3	Very low	42.1	Very low	152 Å²	152	132.4 Å²	132.4	81%	0.813	78%	0.781	S	S	*	*			trans	-115.2	22	-173.1	-77.9	-12.8	0	0	0	115	E136	D134-E136 VanDerWaalsContact C-N 3.31Å; D134-E136 PolarHBondContact O-N 3.04Å
135	L	48	Very low	42.5	Very low	170 Å²	170	134 Å²	134	89%	0.89	78%	0.784	S	S	*	*			trans	-98	63.3	161	-88.7	158.1	0	0	0	109.6	L137	L135-L137 PolarHBondContact O-N 3.34Å; L135-L137 VanDerWaalsContact O-N 3.15Å
136	E	50.3	Low	42.3	Very low	157 Å²	157	137.6 Å²	137.6	73%	0.734	79%	0.787	S	S	*	*			trans	-58.4	113	164.7	-69.5	-170.1	146.9	0	0	109.8	D134 I138	D134-E136 VanDerWaalsContact C-N 3.31Å; D134-E136 PolarHBondContact O-N 3.04Å; E136-I138 PolarHBondContact O-N 2.8Å
137	L	43.5	Very low	42.6	Very low	164 Å²	164	138.7 Å²	138.7	86%	0.859	79%	0.787	S	S	*	*			trans	30.9	84.2	137.3	-75	101.2	0	0	0	116.7	L135	L135-L137 PolarHBondContact O-N 3.34Å; L135-L137 VanDerWaalsContact O-N 3.15Å
138	I	42.3	Very low	42	Very low	182 Å²	182	140 Å²	140	93%	0.933	79%	0.793	S	S	*	*			trans	-110.7	80.1	145.7	-54.6	174.1	0	0	0	106.6	E136	E136-I138 PolarHBondContact O-N 2.8Å
139	G	32.8	Very low	41.9	Very low	67 Å²	67	139.7 Å²	139.7	69%	0.691	79%	0.791	S	S	*	*			trans	-156.3	49.2	179.7	0	0	0	0	0	109.5
140	D	40.4	Very low	41.5	Very low	157 Å²	157	140.8 Å²	140.8	84%	0.84	79%	0.793	S	S	*	*			trans	-88.7	130.4	171.5	-145.5	-9.3	0	0	0	110.7
141	S	35.2	Very low	41.9	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	80%	0.803	S	S	*	*			trans	-59.8	139.4	-170	54	0	0	0	0	114.7
142	G	37.3	Very low	42.2	Very low	69 Å²	69	146.6 Å²	146.6	71%	0.711	81%	0.807	S	S	*	*			trans	172.5	80.5	171.5	0	0	0	0	0	118.2
143	S	36.4	Very low	42	Very low	118 Å²	118	144.9 Å²	144.9	83%	0.825	81%	0.806	S	S	*	*			trans	83.8	126.8	148.9	-57.5	0	0	0	0	120.8
144	P	43.7	Very low	41.8	Very low	122 Å²	122	150.4 Å²	150.4	79%	0.792	82%	0.82	S	S	*	*			trans	-88.6	156	158.8	36.5	-28.8	0	0	0	110.3
145	P	44	Very low	41.4	Very low	119 Å²	119	151.8 Å²	151.8	77%	0.773	82%	0.822	S	S	*	*				-151.2	142.7	105.5	32.8	-13.5	0	0	0	116.3
146	K	37.5	Very low	41.2	Very low	197 Å²	197	148.9 Å²	148.9	86%	0.857	81%	0.813	S	S	*	*			trans	25.5	115.4	137	-67.4	175.6	175.5	174.1	0	118.5
147	K	46.6	Very low	40.7	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	82%	0.821	S	S	*	*				169.8	118.2	114	-93.1	169.7	-178.8	178.5	0	110.9
148	E	39.1	Very low	40.9	Very low	186 Å²	186	148.4 Å²	148.4	87%	0.869	81%	0.811	S	S	*	*			trans	-64.4	153.6	160.1	-64.4	-177.9	153.1	0	0	110.3
149	P	43.8	Very low	41.2	Very low	110 Å²	110	148.5 Å²	148.5	71%	0.714	81%	0.807	S	S	*	*				-148.3	139.1	102.7	33.2	-14.6	0	0	0	116.2
150	K	34.5	Very low	41.8	Very low	202 Å²	202	153.6 Å²	153.6	88%	0.878	81%	0.813	S	S	*	*			trans	39.4	101.8	136	-67.7	175.7	176	174.7	0	118.2
151	I	46.5	Very low	42.6	Very low	170 Å²	170	151.7 Å²	151.7	87%	0.872	80%	0.803	S	S	*	*			trans	-127	124.7	154.2	-60.5	175.3	0	0	0	108.8
152	K	46.4	Very low	43.7	Very low	189 Å²	189	155.6 Å²	155.6	82%	0.822	81%	0.809	S	S	*	*			trans	-58.2	144.3	-177.4	-68.5	169.4	174.4	176.2	0	111.5	Q154	K152-Q154 PolarHBondContact O-N 3.13Å
153	P	42.6	Very low	44.6	Very low	131 Å²	131	157.3 Å²	157.3	85%	0.851	80%	0.798	S	S	*	*			trans	-74.1	111.2	168.6	30.2	-28.2	0	0	0	108.2
154	Q	42.7	Very low	45.5	Very low	186 Å²	186	153 Å²	153	87%	0.869	77%	0.772	S	S	*	*			trans	-101.7	108.3	165.5	-161.5	171.8	29	0	0	106.8	K152 P156	K152-Q154 PolarHBondContact O-N 3.13Å; Q154-P156 WeakPolarHBondContact O-CD 3.3Å
155	E	35.3	Very low	46.2	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	76%	0.76	S	S	*	*			trans	-53.8	121.9	178.6	-64.4	172.6	159.2	0	0	111.2
156	P	44.5	Very low	47.2	Very low	108 Å²	108	151.8 Å²	151.8	70%	0.701	76%	0.757	S	S	*	*			trans	-85.5	116.5	156.6	29.9	-21	0	0	0	107.3	Q154 V158	Q154-P156 WeakPolarHBondContact O-CD 3.3Å; P156-V158 PolarHBondContact O-N 3.28Å
157	K	39.8	Very low	48.4	Very low	205 Å²	205	144.2 Å²	144.2	89%	0.891	72%	0.724	S	S	*	*			trans	-50.6	102.4	162.6	-78.3	175.2	174.1	178.7	0	108.2	E159	K157-E159 PolarHBondContact O-N 2.95Å
158	V	47.4	Very low	49.3	Very low	107 Å²	107	138.2 Å²	138.2	65%	0.648	71%	0.708	S	S	*	*			trans	-81.3	99.1	167.3	-178	0	0	0	0	105.1	P156 E160	P156-V158 PolarHBondContact O-N 3.28Å; V158-E160 HydrophobicContact CB-CG 4.44Å; V158-E160 HydrophobicContact CG1-CG 3.75Å; V158-E160 PolarHBondContact O-N 2.81Å
159	E	49.1	Very low	51.1	Low	183 Å²	183	137.6 Å²	137.6	86%	0.855	71%	0.707	S	S	*	*			trans	-63.8	98.9	154.8	-77.7	-179.7	163.8	0	0	105.8	K157 D161	K157-E159 PolarHBondContact O-N 2.95Å; E159-D161 VanDerWaalsContact C-N 3.32Å; E159-D161 PolarHBondContact O-N 2.85Å
160	E	46	Very low	52.8	Low	175 Å²	175	135.5 Å²	135.5	82%	0.818	69%	0.689	S	S	*	*			trans	-69.9	89	176.5	-69.2	-175.7	153.7	0	0	108.9	V158 E162	V158-E160 HydrophobicContact CB-CG 4.44Å; V158-E160 HydrophobicContact CG1-CG 3.75Å; V158-E160 PolarHBondContact O-N 2.81Å; E160-E162 PolarHBondContact O-N 3.1Å
161	D	55.6	Low	55.2	Low	117 Å²	117	129.6 Å²	129.6	63%	0.626	67%	0.672	S	S	*	*			trans	-64.6	125.1	155.2	-90.6	-21.3	0	0	0	107.4	E159 E163 G164	E159-D161 VanDerWaalsContact C-N 3.32Å; E159-D161 PolarHBondContact O-N 2.85Å; D161-E163 PolarHBondContact O-N 2.69Å; D161-G164 PolarHBondContact O-N 2.81Å
162	E	59.1	Low	56.9	Low	189 Å²	189	126.3 Å²	126.3	88%	0.883	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-21.8	-179.8	-72.8	-176.7	134.9	0	0	113.6	E160	E160-E162 PolarHBondContact O-N 3.1Å
163	E	55.8	Low	58.5	Low	105 Å²	105	122.8 Å²	122.8	49%	0.491	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	-17.2	176.2	-67.9	-178.3	156.4	0	0	114	D161 A165 Q166 F167 R182	D161-E163 PolarHBondContact O-N 2.69Å; E163-A165 VanDerWaalsContact C-N 3.31Å; E163-Q166 WeakPolarHBondContact O-CB 3.45Å; E163-Q166 PolarHBondContact O-N 3.44Å; E163-F167 WeakPolarHBondContact O-CD2 3.27Å; E163-F167 WeakPolarHBondContact O-CE2 3.49Å; E163-R182 IonicContact OE2-CZ 3.15Å; E163-R182 IonicContact OE2-NE 4Å; E163-R182 IonicContact OE2-NH1 3.5Å; E163-R182 IonicContact OE2-NH2 2.59Å; E163-R182 PolarHBondContact OE2-NH2 3.31Å
164	G	55.5	Low	60.1	Low	27 Å²	27	119.3 Å²	119.3	28%	0.278	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.6	-29.4	173.6	0	0	0	0	0	112.7	D161 Q166 F167	D161-G164 PolarHBondContact O-N 2.81Å; G164-Q166 PolarHBondContact O-N 2.81Å; G164-F167 PolarHBondContact O-N 2.84Å
165	A	58.2	Low	61.9	Low	65 Å²	65	112.2 Å²	112.2	54%	0.537	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-64.4	-27.5	174.6	0	0	0	0	0	112.2	E163 F167 S168	E163-A165 VanDerWaalsContact C-N 3.31Å; A165-F167 PolarHBondContact O-N 3.47Å; A165-S168 PolarHBondContact O-N 3.45Å; A165-S168 PolarHBondContact O-OG 2.92Å
166	Q	64.7	Low	63.8	Low	152 Å²	152	109 Å²	109	71%	0.71	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-69	-21.8	-178.1	-136.4	172.4	26.2	0	0	113.1	E163 G164	E163-Q166 WeakPolarHBondContact O-CB 3.45Å; E163-Q166 PolarHBondContact O-N 3.44Å; G164-Q166 PolarHBondContact O-N 2.81Å
167	F	63.7	Low	65.6	Low	38 Å²	38	107.9 Å²	107.9	17%	0.167	57%	0.568	C	S	.	*	G	3₁₀ helix	trans	-97.5	-15.1	179	-57.1	-67	0	0	0	113.5	E163 G164 A165 M169 L170 Q175 L178	E163-F167 WeakPolarHBondContact O-CD2 3.27Å; E163-F167 WeakPolarHBondContact O-CE2 3.49Å; G164-F167 PolarHBondContact O-N 2.84Å; A165-F167 PolarHBondContact O-N 3.47Å; F167-M169 PolarHBondContact O-N 3.48Å; F167-M169 VanDerWaalsContact O-N 3.09Å; F167-L170 HydrophobicContact CD1-CD1 4.42Å; F167-L170 PolarHBondContact O-N 3.13Å; F167-Q175 HydrophobicContact CB-CG 4.39Å; F167-Q175 WeakPolarHBondContact O-CG 3.43Å; F167-Q175 PolarHBondContact O-NE2 3.1Å; F167-L178 HydrophobicContact CD1-CB 3.95Å; F167-L178 HydrophobicContact CD1-CD1 3.6Å; F167-L178 HydrophobicContact CD1-CG 4.41Å; F167-L178 HydrophobicContact CE1-CB 3.89Å; F167-L178 HydrophobicContact CE1-CD1 3.82Å; F167-L178 HydrophobicContact CE1-CG 4.38Å
168	S	65.9	Low	67.4	Low	76 Å²	76	100.8 Å²	100.8	53%	0.531	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.1	-172.5	66.5	0	0	0	0	113.7	A165 L170 Q175	A165-S168 PolarHBondContact O-N 3.45Å; A165-S168 PolarHBondContact O-OG 2.92Å; S168-L170 VanDerWaalsContact C-N 3.31Å; S168-L170 PolarHBondContact O-N 3.07Å; S168-Q175 PolarHBondContact O-NE2 3.3Å
169	M	75.9	Confident	69	Low	172 Å²	172	102 Å²	102	85%	0.847	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.2	177.5	-65.4	-135	68.1	0	0	114.5	F167	F167-M169 PolarHBondContact O-N 3.48Å; F167-M169 VanDerWaalsContact O-N 3.09Å
170	L	78.9	Confident	70.5	Confident	66 Å²	66	101.8 Å²	101.8	35%	0.346	52%	0.524	S	S	.	.	S	Bend	trans	-95.6	154.5	-177.1	-61.9	171.4	0	0	0	111.3	F167 S168 V174 Q175 L178	F167-L170 HydrophobicContact CD1-CD1 4.42Å; F167-L170 PolarHBondContact O-N 3.13Å; S168-L170 VanDerWaalsContact C-N 3.31Å; S168-L170 PolarHBondContact O-N 3.07Å; L170-V174 HydrophobicContact CB-CB 4.18Å; L170-V174 HydrophobicContact CB-CG1 4.14Å; L170-V174 HydrophobicContact CD1-CG1 3.92Å; L170-V174 HydrophobicContact CG-CG1 4.46Å; L170-Q175 HydrophobicContact CB-CG 4.12Å; L170-Q175 WeakPolarHBondContact O-CG 3.45Å; L170-Q175 PolarHBondContact O-NE2 3.01Å; L170-L178 HydrophobicContact CD1-CD1 3.35Å
171	P	85	Confident	72.1	Confident	79 Å²	79	100.1 Å²	100.1	51%	0.513	51%	0.514	S	S	.	.			trans	-54.4	146.4	172.2	-26	34.7	0	0	0	112.2	D173 V174 Q175	P171-D173 VanDerWaalsContact C-N 3.25Å; P171-D173 PolarHBondContact O-N 3.18Å; P171-D173 VanDerWaalsContact O-N 3.1Å; P171-V174 HydrophobicContact CB-CG2 4.32Å; P171-V174 HydrophobicContact CG-CG2 4.46Å; P171-V174 WeakPolarHBondContact O-CB 3.45Å; P171-V174 PolarHBondContact O-N 3.16Å; P171-Q175 PolarHBondContact O-N 3.12Å
172	P	81.8	Confident	73.3	Confident	101 Å²	101	97.9 Å²	97.9	66%	0.656	50%	0.497	S	S	*	.	H	α-helix	trans	-51.4	-38.8	-174.1	-29.5	35.3	0	0	0	114.9	V174 Q175 M176	P172-V174 VanDerWaalsContact C-N 3.34Å; P172-V174 PolarHBondContact O-N 3.09Å; P172-Q175 WeakPolarHBondContact O-CB 3.4Å; P172-Q175 PolarHBondContact O-N 3.18Å; P172-M176 PolarHBondContact O-N 2.79Å
173	D	80.6	Confident	74.1	Confident	114 Å²	114	93.5 Å²	93.5	61%	0.61	48%	0.479	S	S	*	.	H	α-helix	trans	-64.1	-40.2	178.9	-63.9	-23.6	0	0	0	112	P171 M176 I177	P171-D173 VanDerWaalsContact C-N 3.25Å; P171-D173 PolarHBondContact O-N 3.18Å; P171-D173 VanDerWaalsContact O-N 3.1Å; D173-M176 PolarHBondContact O-N 3.06Å; D173-I177 VanDerWaalsContact O-CG1 3.3Å; D173-I177 WeakPolarHBondContact O-CG1 3.45Å; D173-I177 PolarHBondContact O-N 3.27Å
174	V	76.7	Confident	75.1	Confident	58 Å²	58	93 Å²	93	35%	0.352	48%	0.48	S	S	.	.	H	α-helix	trans	-68.8	-41	177.2	-176.9	0	0	0	0	110	L170 P171 P172 M176 I177 L178	L170-V174 HydrophobicContact CB-CB 4.18Å; L170-V174 HydrophobicContact CB-CG1 4.14Å; L170-V174 HydrophobicContact CD1-CG1 3.92Å; L170-V174 HydrophobicContact CG-CG1 4.46Å; P171-V174 HydrophobicContact CB-CG2 4.32Å; P171-V174 HydrophobicContact CG-CG2 4.46Å; P171-V174 WeakPolarHBondContact O-CB 3.45Å; P171-V174 PolarHBondContact O-N 3.16Å; P172-V174 VanDerWaalsContact C-N 3.34Å; P172-V174 PolarHBondContact O-N 3.09Å; V174-M176 VanDerWaalsContact C-N 3.31Å; V174-M176 PolarHBondContact O-N 2.97Å; V174-I177 PolarHBondContact O-N 2.81Å; V174-L178 HydrophobicContact CG1-CD1 3.88Å; V174-L178 HydrophobicContact CG1-CG 4.28Å; V174-L178 WeakPolarHBondContact O-CB 3.31Å; V174-L178 VanDerWaalsContact O-CG 3.31Å; V174-L178 WeakPolarHBondContact O-CG 3.31Å; V174-L178 PolarHBondContact O-N 2.79Å
175	Q	79.7	Confident	75.9	Confident	37 Å²	37	98.2 Å²	98.2	17%	0.173	50%	0.495	C	S	.	.	H	α-helix	trans	-58.6	-44.8	174.3	-60	-170.4	20.3	0	0	111.3	F167 S168 L170 P171 P172 L178 R179	F167-Q175 HydrophobicContact CB-CG 4.39Å; F167-Q175 WeakPolarHBondContact O-CG 3.43Å; F167-Q175 PolarHBondContact O-NE2 3.1Å; S168-Q175 PolarHBondContact O-NE2 3.3Å; L170-Q175 HydrophobicContact CB-CG 4.12Å; L170-Q175 WeakPolarHBondContact O-CG 3.45Å; L170-Q175 PolarHBondContact O-NE2 3.01Å; P171-Q175 PolarHBondContact O-N 3.12Å; P172-Q175 WeakPolarHBondContact O-CB 3.4Å; P172-Q175 PolarHBondContact O-N 3.18Å; Q175-L178 PolarHBondContact O-N 3.28Å; Q175-R179 WeakPolarHBondContact O-CB 3.44Å; Q175-R179 VanDerWaalsContact O-CG 3.25Å; Q175-R179 WeakPolarHBondContact O-CG 3.45Å; Q175-R179 PolarHBondContact O-N 2.88Å
176	M	76.6	Confident	76.6	Confident	114 Å²	114	100.2 Å²	100.2	56%	0.562	49%	0.493	S	S	*	.	H	α-helix	trans	-61.5	-45.4	178	-177.5	-177.8	54.2	0	0	111.6	P172 D173 V174 R180	P172-M176 PolarHBondContact O-N 2.79Å; D173-M176 PolarHBondContact O-N 3.06Å; V174-M176 VanDerWaalsContact C-N 3.31Å; V174-M176 PolarHBondContact O-N 2.97Å; M176-R180 WeakPolarHBondContact O-CB 3.36Å; M176-R180 PolarHBondContact O-N 3.41Å
177	I	80.6	Confident	76.9	Confident	86 Å²	86	96.6 Å²	96.6	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-45.1	177.9	-67.7	164.8	0	0	0	111	D173 V174 R180 K181	D173-I177 VanDerWaalsContact O-CG1 3.3Å; D173-I177 WeakPolarHBondContact O-CG1 3.45Å; D173-I177 PolarHBondContact O-N 3.27Å; V174-I177 PolarHBondContact O-N 2.81Å; I177-R180 PolarHBondContact O-N 2.94Å; I177-K181 HydrophobicContact CG2-CD 4.33Å; I177-K181 HydrophobicContact CG2-CG 4.49Å; I177-K181 PolarHBondContact O-N 2.88Å
178	L	79.5	Confident	77	Confident	55 Å²	55	98.8 Å²	98.8	29%	0.288	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-42.1	-179.1	-70.3	174.7	0	0	0	111.8	F167 L170 V174 Q175 R180 K181 R182	F167-L178 HydrophobicContact CD1-CB 3.95Å; F167-L178 HydrophobicContact CD1-CD1 3.6Å; F167-L178 HydrophobicContact CD1-CG 4.41Å; F167-L178 HydrophobicContact CE1-CB 3.89Å; F167-L178 HydrophobicContact CE1-CD1 3.82Å; F167-L178 HydrophobicContact CE1-CG 4.38Å; L170-L178 HydrophobicContact CD1-CD1 3.35Å; V174-L178 HydrophobicContact CG1-CD1 3.88Å; V174-L178 HydrophobicContact CG1-CG 4.28Å; V174-L178 WeakPolarHBondContact O-CB 3.31Å; V174-L178 VanDerWaalsContact O-CG 3.31Å; V174-L178 WeakPolarHBondContact O-CG 3.31Å; V174-L178 PolarHBondContact O-N 2.79Å; Q175-L178 PolarHBondContact O-N 3.28Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 3.44Å; L178-K181 PolarHBondContact O-N 3.11Å; L178-R182 VanDerWaalsContact O-CB 3.31Å; L178-R182 WeakPolarHBondContact O-CB 3.46Å; L178-R182 PolarHBondContact O-N 3.37Å
179	R	80.2	Confident	77	Confident	134 Å²	134	98.1 Å²	98.1	51%	0.506	48%	0.484	S	S	.	.	H	α-helix	trans	-58.4	-43.3	171.8	-73.7	176.9	-177.9	-172.7	2	111.4	Q175 R182 N183	Q175-R179 WeakPolarHBondContact O-CB 3.44Å; Q175-R179 VanDerWaalsContact O-CG 3.25Å; Q175-R179 WeakPolarHBondContact O-CG 3.45Å; Q175-R179 PolarHBondContact O-N 2.88Å; R179-R182 PolarHBondContact O-N 3.23Å; R179-N183 PolarHBondContact O-N 3.04Å
180	R	80.1	Confident	76.5	Confident	178 Å²	178	97.4 Å²	97.4	67%	0.672	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-45.9	177.4	-162.5	-179.2	-148.6	161.6	6.5	112.5	M176 I177 L178 R182 N183 N184	M176-R180 WeakPolarHBondContact O-CB 3.36Å; M176-R180 PolarHBondContact O-N 3.41Å; I177-R180 PolarHBondContact O-N 2.94Å; L178-R180 VanDerWaalsContact C-N 3.31Å; L178-R180 PolarHBondContact O-N 3.44Å; R180-R182 VanDerWaalsContact C-N 3.35Å; R180-N183 PolarHBondContact O-N 3.43Å; R180-N184 PolarHBondContact O-N 3.32Å
181	K	80.7	Confident	75.7	Confident	139 Å²	139	100.7 Å²	100.7	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-63.1	-41.1	177	-77.4	-173	177.1	-178.3	0	111.7	I177 L178 N184 F185	I177-K181 HydrophobicContact CG2-CD 4.33Å; I177-K181 HydrophobicContact CG2-CG 4.49Å; I177-K181 PolarHBondContact O-N 2.88Å; L178-K181 PolarHBondContact O-N 3.11Å; K181-N184 PolarHBondContact O-N 2.97Å; K181-F185 WeakPolarHBondContact O-CB 3.41Å; K181-F185 PolarHBondContact O-N 2.9Å
182	R	79.3	Confident	74.5	Confident	71 Å²	71	102.9 Å²	102.9	27%	0.268	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-46.2	176.5	-176.8	177.3	174.6	-163.2	-11.5	111.6	E163 L178 R179 R180 N184 F185 Q186	E163-R182 IonicContact OE2-CZ 3.15Å; E163-R182 IonicContact OE2-NE 4Å; E163-R182 IonicContact OE2-NH1 3.5Å; E163-R182 IonicContact OE2-NH2 2.59Å; E163-R182 PolarHBondContact OE2-NH2 3.31Å; L178-R182 VanDerWaalsContact O-CB 3.31Å; L178-R182 WeakPolarHBondContact O-CB 3.46Å; L178-R182 PolarHBondContact O-N 3.37Å; R179-R182 PolarHBondContact O-N 3.23Å; R180-R182 VanDerWaalsContact C-N 3.35Å; R182-N184 VanDerWaalsContact C-N 3.34Å; R182-N184 PolarHBondContact O-N 3.42Å; R182-F185 PolarHBondContact O-N 2.99Å; R182-Q186 PolarHBondContact O-N 3.36Å
183	N	77.3	Confident	73.2	Confident	97 Å²	97	108.1 Å²	108.1	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-61.3	-43.1	177.1	-72.4	-7	0	0	0	111.6	R179 R180 F185 Q186 V187	R179-N183 PolarHBondContact O-N 3.04Å; R180-N183 PolarHBondContact O-N 3.43Å; N183-F185 VanDerWaalsContact C-N 3.35Å; N183-F185 PolarHBondContact O-N 2.95Å; N183-Q186 PolarHBondContact O-N 2.94Å; N183-V187 WeakPolarHBondContact O-CG2 3.36Å; N183-V187 PolarHBondContact O-N 3.07Å
184	N	77	Confident	71.8	Confident	94 Å²	94	109.2 Å²	109.2	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-42.9	175.1	-69.8	-8.4	0	0	0	111.8	R180 K181 R182 Q186 V187 D188	R180-N184 PolarHBondContact O-N 3.32Å; K181-N184 PolarHBondContact O-N 2.97Å; R182-N184 VanDerWaalsContact C-N 3.34Å; R182-N184 PolarHBondContact O-N 3.42Å; N184-Q186 PolarHBondContact O-N 3.23Å; N184-V187 PolarHBondContact O-N 2.88Å; N184-D188 PolarHBondContact O-N 3.43Å
185	F	72.4	Confident	70.4	Confident	136 Å²	136	117.9 Å²	117.9	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-63.8	-39.4	178.2	-172.8	-97.6	0	0	0	112.7	K181 R182 N183 D188 M189	K181-F185 WeakPolarHBondContact O-CB 3.41Å; K181-F185 PolarHBondContact O-N 2.9Å; R182-F185 PolarHBondContact O-N 2.99Å; N183-F185 VanDerWaalsContact C-N 3.35Å; N183-F185 PolarHBondContact O-N 2.95Å; F185-D188 PolarHBondContact O-N 2.59Å; F185-M189 HydrophobicContact CD1-CG 4.17Å; F185-M189 HydrophobicContact CE1-CG 3.72Å; F185-M189 HydrophobicContact CE1-SD 4.48Å; F185-M189 HydrophobicContact CZ-CG 3.94Å; F185-M189 HydrophobicContact CZ-SD 4.38Å; F185-M189 WeakPolarHBondContact O-CB 3.18Å; F185-M189 PolarHBondContact O-N 3.46Å
186	Q	71.7	Confident	68.9	Low	107 Å²	107	119 Å²	119	50%	0.5	55%	0.55	S	S	.	.	H	α-helix	trans	-64.6	-40.4	174.2	-76.2	-174.2	1.8	0	0	112.1	R182 N183 N184 M189 K190	R182-Q186 PolarHBondContact O-N 3.36Å; N183-Q186 PolarHBondContact O-N 2.94Å; N184-Q186 PolarHBondContact O-N 3.23Å; Q186-M189 PolarHBondContact O-N 3.42Å; Q186-K190 WeakPolarHBondContact O-CB 3.45Å; Q186-K190 PolarHBondContact O-N 3.47Å
187	V	70.3	Confident	67.6	Low	76 Å²	76	121.9 Å²	121.9	46%	0.461	56%	0.562	S	S	.	*	H	α-helix	trans	-62.4	-44.4	174.5	171.8	0	0	0	0	110.8	N183 N184 K190 K191	N183-V187 WeakPolarHBondContact O-CG2 3.36Å; N183-V187 PolarHBondContact O-N 3.07Å; N184-V187 PolarHBondContact O-N 2.88Å; V187-K190 PolarHBondContact O-N 3.2Å; V187-K191 HydrophobicContact CG1-CD 4.47Å; V187-K191 WeakPolarHBondContact O-CG 3.25Å; V187-K191 PolarHBondContact O-N 3.07Å
188	D	66.2	Low	65.9	Low	84 Å²	84	126.8 Å²	126.8	45%	0.449	58%	0.58	S	S	.	*	H	α-helix	trans	-65.1	-41.4	178.1	-72.5	-18.8	0	0	0	111.7	N184 F185 K190 K191 I192	N184-D188 PolarHBondContact O-N 3.43Å; F185-D188 PolarHBondContact O-N 2.59Å; D188-K190 VanDerWaalsContact C-N 3.32Å; D188-K190 PolarHBondContact O-N 2.91Å; D188-K191 PolarHBondContact O-N 3.4Å; D188-I192 WeakPolarHBondContact O-CD1 3.43Å; D188-I192 VanDerWaalsContact O-CG1 3.27Å; D188-I192 WeakPolarHBondContact O-CG1 3.4Å; D188-I192 PolarHBondContact O-N 3.02Å
189	M	66.1	Low	64.4	Low	62 Å²	62	133.6 Å²	133.6	31%	0.305	60%	0.602	S	S	.	*	H	α-helix	trans	-66.3	-34.3	176.6	-81.9	-88.3	53.9	0	0	113.1	F185 Q186 I192 R193	F185-M189 HydrophobicContact CD1-CG 4.17Å; F185-M189 HydrophobicContact CE1-CG 3.72Å; F185-M189 HydrophobicContact CE1-SD 4.48Å; F185-M189 HydrophobicContact CZ-CG 3.94Å; F185-M189 HydrophobicContact CZ-SD 4.38Å; F185-M189 WeakPolarHBondContact O-CB 3.18Å; F185-M189 PolarHBondContact O-N 3.46Å; Q186-M189 PolarHBondContact O-N 3.42Å; M189-I192 HydrophobicContact CE-CB 3.83Å; M189-I192 HydrophobicContact CE-CD1 4.01Å; M189-I192 HydrophobicContact CE-CG2 3.96Å; M189-I192 PolarHBondContact O-N 3.34Å; M189-R193 WeakPolarHBondContact O-CB 3.3Å; M189-R193 PolarHBondContact O-N 2.88Å
190	K	66.7	Low	62.5	Low	157 Å²	157	135.9 Å²	135.9	68%	0.683	62%	0.618	S	S	*	*	H	α-helix	trans	-66	-41.9	173.6	-162.8	175.8	-178.9	-178.3	0	111.1	Q186 V187 D188 I192 R193 E194	Q186-K190 WeakPolarHBondContact O-CB 3.45Å; Q186-K190 PolarHBondContact O-N 3.47Å; V187-K190 PolarHBondContact O-N 3.2Å; D188-K190 VanDerWaalsContact C-N 3.32Å; D188-K190 PolarHBondContact O-N 2.91Å; K190-I192 VanDerWaalsContact C-N 3.33Å; K190-I192 PolarHBondContact O-N 3.45Å; K190-R193 PolarHBondContact O-N 3.27Å; K190-E194 PolarHBondContact O-N 3.34Å; K190-E194 VanDerWaalsContact O-N 3.11Å
191	K	61.3	Low	60.9	Low	135 Å²	135	135.8 Å²	135.8	59%	0.587	62%	0.623	S	S	*	*	H	α-helix	trans	-64.1	-33.5	174.7	-72.9	177.3	-179.7	176.9	0	113.4	V187 D188	V187-K191 HydrophobicContact CG1-CD 4.47Å; V187-K191 WeakPolarHBondContact O-CG 3.25Å; V187-K191 PolarHBondContact O-N 3.07Å; D188-K191 PolarHBondContact O-N 3.4Å
192	I	58.8	Low	59	Low	126 Å²	126	134 Å²	134	65%	0.646	63%	0.628	S	S	*	*	H	α-helix	trans	-77.8	-30.3	177.7	-64.5	160.8	0	0	0	111.6	D188 M189 K190	D188-I192 WeakPolarHBondContact O-CD1 3.43Å; D188-I192 VanDerWaalsContact O-CG1 3.27Å; D188-I192 WeakPolarHBondContact O-CG1 3.4Å; D188-I192 PolarHBondContact O-N 3.02Å; M189-I192 HydrophobicContact CE-CB 3.83Å; M189-I192 HydrophobicContact CE-CD1 4.01Å; M189-I192 HydrophobicContact CE-CG2 3.96Å; M189-I192 PolarHBondContact O-N 3.34Å; K190-I192 VanDerWaalsContact C-N 3.33Å; K190-I192 PolarHBondContact O-N 3.45Å
193	R	55.2	Low	57.4	Low	210 Å²	210	142 Å²	142	79%	0.792	66%	0.658	S	S	*	*	H	α-helix	trans	-79.7	-14.5	175.1	-79.7	-175.3	-177.5	167	2.4	114	M189 K190 R195	M189-R193 WeakPolarHBondContact O-CB 3.3Å; M189-R193 PolarHBondContact O-N 2.88Å; K190-R193 PolarHBondContact O-N 3.27Å; R193-R195 VanDerWaalsContact C-N 3.33Å; R193-R195 PolarHBondContact O-N 2.89Å
194	E	51.8	Low	56.3	Low	138 Å²	138	146.3 Å²	146.3	65%	0.645	67%	0.672	S	S	*	*	S	Bend	trans	-62.8	101.6	165.6	-79.9	179.5	-175.8	0	0	108.2	K190 G196	K190-E194 PolarHBondContact O-N 3.34Å; K190-E194 VanDerWaalsContact O-N 3.11Å; E194-G196 PolarHBondContact O-N 3.45Å
195	R	47.3	Very low	54.8	Low	240 Å²	240	149.7 Å²	149.7	91%	0.906	69%	0.69	S	S	*	*			trans	-42.3	93.8	179.6	-158.8	179	-166.2	168.7	2.6	109.3	R193 E197	R193-R195 VanDerWaalsContact C-N 3.33Å; R193-R195 PolarHBondContact O-N 2.89Å; R195-E197 PolarHBondContact O-N 3.37Å
196	G	48.6	Very low	53.1	Low	59 Å²	59	149.5 Å²	149.5	61%	0.608	70%	0.7	S	S	*	*			trans	-49.6	120.8	177	0	0	0	0	0	108.4	E194 F198	E194-G196 PolarHBondContact O-N 3.45Å; G196-F198 PolarHBondContact O-N 2.9Å
197	E	49.5	Very low	51.5	Low	176 Å²	176	148.8 Å²	148.8	82%	0.822	71%	0.713	S	S	*	*			trans	-50.9	103.3	178.9	-72.5	177.3	150.8	0	0	108.4	R195 R199	R195-E197 PolarHBondContact O-N 3.37Å; E197-R199 PolarHBondContact O-N 3.35Å
198	F	43.5	Very low	49.9	Very low	188 Å²	188	149.9 Å²	149.9	83%	0.825	72%	0.723	S	S	*	*			trans	-60.2	96.8	160.7	-96.1	-92.9	0	0	0	105.4	G196 H200	G196-F198 PolarHBondContact O-N 2.9Å; F198-H200 VanDerWaalsContact C-N 3.28Å; F198-H200 PolarHBondContact O-N 2.79Å
199	R	47.4	Very low	48.6	Very low	198 Å²	198	150.2 Å²	150.2	75%	0.747	74%	0.738	S	S	*	*			trans	-57.3	99	166.6	-73.4	-176.6	167.5	-166.6	-3.7	106.6	E197 F201	E197-R199 PolarHBondContact O-N 3.35Å; R199-F201 VanDerWaalsContact C-N 3.26Å; R199-F201 HydrophobicContact CB-CD2 4.45Å; R199-F201 HydrophobicContact CB-CE2 4.19Å; R199-F201 WeakPolarHBondContact O-CD2 3.45Å; R199-F201 PolarHBondContact O-N 3.34Å
200	H	42.3	Very low	47.4	Very low	183 Å²	183	152.7 Å²	152.7	85%	0.847	76%	0.757	S	S	*	*			trans	-62.7	93	168	-80.6	-33.6	0	0	0	107.5	F198 S202	F198-H200 VanDerWaalsContact C-N 3.28Å; F198-H200 PolarHBondContact O-N 2.79Å; H200-S202 PolarHBondContact O-N 3.27Å; H200-S202 VanDerWaalsContact O-N 3.1Å
201	F	45.1	Very low	46.3	Very low	175 Å²	175	152.5 Å²	152.5	77%	0.768	76%	0.762	S	S	*	*			trans	-63	113.5	166.7	-78.9	-84.4	0	0	0	107.7	R199 R203	R199-F201 VanDerWaalsContact C-N 3.26Å; R199-F201 HydrophobicContact CB-CD2 4.45Å; R199-F201 HydrophobicContact CB-CE2 4.19Å; R199-F201 WeakPolarHBondContact O-CD2 3.45Å; R199-F201 PolarHBondContact O-N 3.34Å; F201-R203 PolarHBondContact O-N 3.35Å
202	S	41.1	Very low	45.3	Very low	102 Å²	102	152.2 Å²	152.2	71%	0.713	77%	0.766	S	S	*	*			trans	-52.3	125.9	176.3	67.9	0	0	0	0	110.2	H200 K204	H200-S202 PolarHBondContact O-N 3.27Å; H200-S202 VanDerWaalsContact O-N 3.1Å; S202-K204 PolarHBondContact O-N 2.89Å
203	R	46.4	Very low	44.5	Very low	240 Å²	240	152.9 Å²	152.9	91%	0.906	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	52.7	-174.5	-63	-179	-179	-178	0.1	113	F201	F201-R203 PolarHBondContact O-N 3.35Å
204	K	54.3	Low	43.8	Very low	187 Å²	187	151.1 Å²	151.1	81%	0.813	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-5.7	179	-74.4	-168.7	176.9	-177.1	0	115.7	S202	S202-K204 PolarHBondContact O-N 2.89Å
205	N	43.9	Very low	43.2	Very low	164 Å²	164	149.9 Å²	149.9	88%	0.877	77%	0.771	S	S	*	*	S	Bend	trans	-124.5	86.5	168.8	-74.4	-24.3	0	0	0	109.7	A207	N205-A207 PolarHBondContact O-N 3.09Å; N205-A207 VanDerWaalsContact O-N 3.11Å
206	V	36.9	Very low	42.8	Very low	132 Å²	132	146.6 Å²	146.6	80%	0.8	77%	0.765	S	S	*	*			trans	-76.6	89.4	174.4	-178.7	0	0	0	0	108.2
207	A	37.9	Very low	42.5	Very low	93 Å²	93	153.1 Å²	153.1	77%	0.769	78%	0.777	S	S	*	*			trans	-104.2	98.1	149.8	0	0	0	0	0	105.9	N205 A209	N205-A207 PolarHBondContact O-N 3.09Å; N205-A207 VanDerWaalsContact O-N 3.11Å; A207-A209 PolarHBondContact O-N 3.04Å
208	S	38.3	Very low	42.1	Very low	98 Å²	98	150 Å²	150	69%	0.685	77%	0.77	S	S	*	*			trans	-58	99.9	174.8	50.9	0	0	0	0	109.5	T210	S208-T210 PolarHBondContact O-N 3.49Å; S208-T210 VanDerWaalsContact O-N 3.13Å
209	A	38.1	Very low	41.9	Very low	92 Å²	92	145.1 Å²	145.1	76%	0.76	77%	0.765	S	S	*	*			trans	-77.7	86.2	158	0	0	0	0	0	106.8	A207 I211	A207-A209 PolarHBondContact O-N 3.04Å; A209-I211 PolarHBondContact O-N 3.19Å
210	T	40.2	Very low	41.9	Very low	114 Å²	114	142.3 Å²	142.3	70%	0.699	76%	0.763	S	S	*	*			trans	-60.3	106.7	158.3	0.5	0	0	0	0	105.9	S208 L212	S208-T210 PolarHBondContact O-N 3.49Å; S208-T210 VanDerWaalsContact O-N 3.13Å; T210-L212 PolarHBondContact O-N 3.42Å
211	I	44.4	Very low	41.8	Very low	152 Å²	152	143.5 Å²	143.5	78%	0.779	76%	0.76	S	S	*	*			trans	-63	96	161.7	-61.6	173.2	0	0	0	104.3	A209 D213	A209-I211 PolarHBondContact O-N 3.19Å; I211-D213 PolarHBondContact O-N 2.94Å
212	L	40.7	Very low	41.9	Very low	129 Å²	129	141.2 Å²	141.2	68%	0.675	76%	0.755	S	S	*	*			trans	-67.9	92.2	166.6	-90.1	161.9	0	0	0	105.7	T210 K214	T210-L212 PolarHBondContact O-N 3.42Å; L212-K214 HydrophobicContact CD2-CD 4.27Å; L212-K214 HydrophobicContact CD2-CG 4.21Å; L212-K214 PolarHBondContact O-N 2.9Å
213	D	42.4	Very low	42.5	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	75%	0.754	S	S	*	*			trans	-69.1	60.9	164.6	-141.6	8.6	0	0	0	108.2	I211 V215	I211-D213 PolarHBondContact O-N 2.94Å; D213-V215 PolarHBondContact O-N 3.36Å
214	K	40.4	Very low	42.7	Very low	173 Å²	173	136.9 Å²	136.9	75%	0.752	74%	0.741	S	S	*	*			trans	-91.4	70.8	164.9	-78.5	-173.2	176.2	-179.5	0	106.5	L212 Q216	L212-K214 HydrophobicContact CD2-CD 4.27Å; L212-K214 HydrophobicContact CD2-CG 4.21Å; L212-K214 PolarHBondContact O-N 2.9Å; K214-Q216 PolarHBondContact O-N 3.39Å
215	V	39.1	Very low	42.5	Very low	112 Å²	112	133.1 Å²	133.1	68%	0.679	74%	0.736	S	S	*	*			trans	-62.9	97	154.5	179.9	0	0	0	0	105.4	D213 K217	D213-V215 PolarHBondContact O-N 3.36Å; V215-K217 VanDerWaalsContact C-N 3.27Å; V215-K217 PolarHBondContact O-N 3.27Å
216	Q	38.2	Very low	42.9	Very low	170 Å²	170	134.3 Å²	134.3	79%	0.794	73%	0.728	S	S	*	*			trans	-57.5	102.9	160	-117.2	177.4	-1.2	0	0	105.2	K214 V218	K214-Q216 PolarHBondContact O-N 3.39Å; Q216-V218 HydrophobicContact CB-CG2 4.32Å; Q216-V218 PolarHBondContact O-N 2.91Å
217	K	42.5	Very low	43.8	Very low	197 Å²	197	137.9 Å²	137.9	86%	0.857	73%	0.727	S	S	*	*			trans	-61.2	83.2	157.8	-80.1	-177.3	177	177.5	0	105.9	V215 A219	V215-K217 VanDerWaalsContact C-N 3.27Å; V215-K217 PolarHBondContact O-N 3.27Å; K217-A219 PolarHBondContact O-N 3.06Å
218	V	40.4	Very low	45	Very low	109 Å²	109	141.6 Å²	141.6	66%	0.661	73%	0.726	S	S	*	*			trans	-67.6	99.2	158.3	-176.4	0	0	0	0	103.3	Q216 I220	Q216-V218 HydrophobicContact CB-CG2 4.32Å; Q216-V218 PolarHBondContact O-N 2.91Å; V218-I220 VanDerWaalsContact C-N 3.26Å; V218-I220 PolarHBondContact O-N 3.29Å
219	A	40.5	Very low	45.9	Very low	87 Å²	87	144.6 Å²	144.6	72%	0.719	73%	0.729	S	S	*	*			trans	-56.9	101.8	164.4	0	0	0	0	0	105.6	K217 R221	K217-A219 PolarHBondContact O-N 3.06Å; A219-R221 PolarHBondContact O-N 2.99Å
220	I	46	Very low	47	Very low	138 Å²	138	147.1 Å²	147.1	71%	0.708	73%	0.729	S	S	*	*			trans	-57.8	105.5	160.1	-62.3	173.7	0	0	0	102.9	V218 N222	V218-I220 VanDerWaalsContact C-N 3.26Å; V218-I220 PolarHBondContact O-N 3.29Å; I220-N222 VanDerWaalsContact C-N 3.26Å; I220-N222 PolarHBondContact O-N 3.02Å
221	R	41.4	Very low	48.2	Very low	209 Å²	209	153 Å²	153	79%	0.789	74%	0.738	S	S	*	*			trans	-54.9	104	167.5	-111.6	-179.3	170	160.8	-4.2	104.7	A219 D223	A219-R221 PolarHBondContact O-N 2.99Å; R221-D223 PolarHBondContact O-N 2.95Å
222	N	48	Very low	49.5	Very low	126 Å²	126	149.9 Å²	149.9	67%	0.674	74%	0.735	S	S	*	*			trans	-69.5	70.5	164.7	-77	-30.1	0	0	0	106.7	I220 I224	I220-N222 VanDerWaalsContact C-N 3.26Å; I220-N222 PolarHBondContact O-N 3.02Å; N222-I224 PolarHBondContact O-N 3.1Å; N222-I224 VanDerWaalsContact O-N 3.08Å
223	D	51.9	Low	51.1	Low	129 Å²	129	149 Å²	149	69%	0.69	74%	0.737	S	S	*	*			trans	-76.8	33	161.8	-74.4	-24.8	0	0	0	109.7	R221 P225	R221-D223 PolarHBondContact O-N 2.95Å; D223-P225 WeakPolarHBondContact O-CD 3.39Å
224	I	50.5	Low	52.3	Low	123 Å²	123	148 Å²	148	63%	0.631	74%	0.738	S	S	*	*			trans	-72.8	117.7	164.2	-59.1	173.6	0	0	0	105	N222 R226	N222-I224 PolarHBondContact O-N 3.1Å; N222-I224 VanDerWaalsContact O-N 3.08Å; I224-R226 PolarHBondContact O-N 3.46Å
225	P	50.3	Low	53.7	Low	107 Å²	107	149.9 Å²	149.9	70%	0.695	75%	0.746	S	S	*	*			trans	-53.5	120.2	175.3	-20.7	31.1	0	0	0	108	D223 W227	D223-P225 WeakPolarHBondContact O-CD 3.39Å; P225-W227 PolarHBondContact O-N 3.46Å
226	R	52.9	Low	54.8	Low	190 Å²	190	156.8 Å²	156.8	72%	0.717	78%	0.775	S	S	*	*			trans	-51.6	115.6	168.1	-81.6	179.4	163.5	-171.2	-3.6	106.5	I224 K228 H229	I224-R226 PolarHBondContact O-N 3.46Å; R226-K228 PolarHBondContact O-N 3.02Å; R226-H229 PolarHBondContact O-N 2.74Å; R226-H229 PolarHBondContact O-ND1 3.15Å
227	W	55.9	Low	55.7	Low	206 Å²	206	156.2 Å²	156.2	78%	0.78	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-45.1	-15.2	177.4	25.5	-70.1	0	0	0	113.8	P225 H229 L230	P225-W227 PolarHBondContact O-N 3.46Å; W227-H229 PolarHBondContact O-N 3.23Å; W227-L230 HydrophobicContact CB-CD1 4.45Å; W227-L230 PolarHBondContact O-N 2.98Å
228	K	62	Low	56.4	Low	171 Å²	171	154 Å²	154	74%	0.743	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-62.6	-8.5	169.1	-58.4	-169	177	-170.9	0	115.7	R226	R226-K228 PolarHBondContact O-N 3.02Å
229	H	59.2	Low	57.2	Low	161 Å²	161	156.5 Å²	156.5	75%	0.745	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-103.6	0.9	174.4	-62.8	85.1	0	0	0	114.3	R226 W227 R231	R226-H229 PolarHBondContact O-N 2.74Å; R226-H229 PolarHBondContact O-ND1 3.15Å; W227-H229 PolarHBondContact O-N 3.23Å; H229-R231 PolarHBondContact O-N 3.33Å
230	L	59.7	Low	58.2	Low	145 Å²	145	160.6 Å²	160.6	76%	0.759	78%	0.778	S	S	*	*	S	Bend	trans	-73	113.6	172	-72	164.7	0	0	0	108.1	W227 A232	W227-L230 HydrophobicContact CB-CD1 4.45Å; W227-L230 PolarHBondContact O-N 2.98Å; L230-A232 PolarHBondContact O-N 3.31Å
231	R	65.2	Low	59	Low	238 Å²	238	162 Å²	162	90%	0.898	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-49.4	135.2	170.5	-88.5	-177.3	-179.2	173.3	0.4	108.7	H229	H229-R231 PolarHBondContact O-N 3.33Å
232	A	73	Confident	60.2	Low	87 Å²	87	158.9 Å²	158.9	72%	0.719	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-54.4	140.8	168.2	0	0	0	0	0	109.2	L230	L230-A232 PolarHBondContact O-N 3.31Å
233	P	72.6	Confident	61	Low	111 Å²	111	161.2 Å²	161.2	72%	0.721	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-57.6	145.8	172.6	24.6	-31.9	0	0	0	109.5	K235	P233-K235 PolarHBondContact O-N 2.87Å
234	P	68.6	Low	61.7	Low	119 Å²	119	163.7 Å²	163.7	77%	0.773	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-58.5	134.7	174.8	24.3	-31.3	0	0	0	109.3	M236	P234-M236 PolarHBondContact O-N 3.22Å
235	K	68.9	Low	62.7	Low	212 Å²	212	167.1 Å²	167.1	92%	0.922	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.1	172.2	-70.2	-178.6	177.8	178.7	0	108	P233	P233-K235 PolarHBondContact O-N 2.87Å
236	M	63.8	Low	63.8	Low	258 Å²	258	172.5 Å²	172.5	100%	1.271	82%	0.823	S	S	*	*			trans	-93.2	0	157.8	-71.7	-168.7	134.1	0	0	108.8	P234	P234-M236 PolarHBondContact O-N 3.22Å

Retrieved 236 of 236 residues in 86.8 ms (Link to these results)

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