A0A077YVY8_TRITR Loading...

RNA-binding protein pno-1

AlphaFold DB , UniProt , Accession A0A077YVY8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 219 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	47.5	Very low	231 Å²	231	152.5 Å²	152.5	100%	1.138	87%	0.871	S	S	*	*				0	85.8	0	-71.5	168.7	175.1	0	0	105.7
2	E	42.1	Very low	47.1	Very low	182 Å²	182	150 Å²	150	85%	0.85	86%	0.86	S	S	*	*				94	97	112.6	-92.8	174.5	125.1	0	0	109.5
3	A	41.8	Very low	46.5	Very low	101 Å²	101	153.3 Å²	153.3	84%	0.835	86%	0.863	S	S	*	*				73.3	106.9	73.2	0	0	0	0	0	113.3
4	A	57.9	Low	46.4	Very low	105 Å²	105	148.6 Å²	148.6	87%	0.868	85%	0.853	S	S	*	*			trans	-161	92.3	150.6	0	0	0	0	0	110.1
5	V	47.5	Very low	45.5	Very low	132 Å²	132	148.3 Å²	148.3	80%	0.8	86%	0.855	S	S	*	*			trans	-80.7	136.6	164.3	172.3	0	0	0	0	107.4	E7	V5-E7 HydrophobicContact CG1-CG 4.04Å
6	S	54.2	Low	45.1	Very low	123 Å²	123	151.4 Å²	151.4	86%	0.86	86%	0.856	S	S	*	*			trans	-131.2	113.2	160.3	51.3	0	0	0	0	109.4
7	E	43	Very low	44.9	Very low	168 Å²	168	150.5 Å²	150.5	79%	0.785	85%	0.854	S	S	*	*			trans	-85.2	154.5	172.3	-62.7	176.6	142.6	0	0	110	V5	V5-E7 HydrophobicContact CG1-CG 4.04Å
8	T	59	Low	44.7	Very low	138 Å²	138	155.4 Å²	155.4	85%	0.847	86%	0.857	S	S	*	*			trans	164.6	154.6	137.5	39.1	0	0	0	0	110.3
9	P	45.3	Very low	44.8	Very low	123 Å²	123	157.1 Å²	157.1	80%	0.799	86%	0.858	S	S	*	*				-132.6	174.7	-61.9	30	-8.8	0	0	0	113.2
10	M	41.4	Very low	45.1	Very low	173 Å²	173	155.8 Å²	155.8	85%	0.852	86%	0.855	S	S	*	*			trans	-46.3	139.9	174.8	-93.6	167.3	158.3	0	0	116.9
11	E	45.4	Very low	45.1	Very low	202 Å²	202	151.8 Å²	151.8	94%	0.944	85%	0.849	S	S	*	*			trans	-130	137.3	140.5	-113.4	177.3	179.1	0	0	109.5
12	V	42.1	Very low	45.6	Very low	122 Å²	122	147 Å²	147	74%	0.739	83%	0.832	S	S	*	*			trans	-109.5	120.3	-164.7	-170.1	0	0	0	0	108.4
13	E	39.9	Very low	46.3	Very low	193 Å²	193	149 Å²	149	90%	0.902	83%	0.832	S	S	*	*			trans	-139	112.6	166.2	-110.6	-173.2	170.8	0	0	113.5
14	A	45	Very low	46.9	Very low	87 Å²	87	150 Å²	150	72%	0.719	83%	0.83	S	S	*	*			trans	44.5	106.9	145.3	0	0	0	0	0	119.7	K16	A14-K16 PolarHBondContact O-N 2.85Å
15	T	32.4	Very low	46.9	Very low	145 Å²	145	156.5 Å²	156.5	89%	0.89	83%	0.832	S	S	*	*			trans	-45.9	112.3	159.9	37	0	0	0	0	113.3
16	K	40.3	Very low	47.5	Very low	198 Å²	198	161.4 Å²	161.4	86%	0.861	84%	0.836	S	S	*	*			trans	-111.3	108.6	156.9	-99.5	177.7	-179.9	171	0	109.8	A14 R18	A14-K16 PolarHBondContact O-N 2.85Å; K16-R18 PolarHBondContact O-N 3.32Å
17	T	40.9	Very low	47.5	Very low	136 Å²	136	161.3 Å²	161.3	83%	0.834	83%	0.833	S	S	*	*			trans	-45.7	105.9	171.4	-38.9	0	0	0	0	110.6	Q19	T17-Q19 PolarHBondContact O-N 3.26Å; T17-Q19 VanDerWaalsContact O-N 3.16Å
18	R	41.4	Very low	48.3	Very low	239 Å²	239	161.3 Å²	161.3	90%	0.902	84%	0.838	S	S	*	*			trans	-73	107.8	173.5	-79	176	98.2	170.3	5.9	108.8	K16 V20	K16-R18 PolarHBondContact O-N 3.32Å; R18-V20 PolarHBondContact O-N 3.36Å
19	Q	47.4	Very low	48	Very low	186 Å²	186	165.7 Å²	165.7	87%	0.869	84%	0.839	S	S	*	*			trans	-55	125.5	172.3	-65.7	175.6	1.1	0	0	110.1	T17 G21	T17-Q19 PolarHBondContact O-N 3.26Å; T17-Q19 VanDerWaalsContact O-N 3.16Å; Q19-G21 PolarHBondContact O-N 3.07Å; Q19-G21 VanDerWaalsContact O-N 3.1Å
20	V	49.3	Very low	48.4	Very low	132 Å²	132	171.1 Å²	171.1	80%	0.8	84%	0.843	S	S	*	*			trans	-60.9	109.6	170.8	176.6	0	0	0	0	107.6	R18 V22	R18-V20 PolarHBondContact O-N 3.36Å; V20-V22 PolarHBondContact O-N 2.95Å
21	G	46.1	Very low	49.1	Very low	71 Å²	71	169.6 Å²	169.6	73%	0.732	83%	0.834	S	S	*	*			trans	-63.2	95.7	177.6	0	0	0	0	0	111.1	Q19 R23	Q19-G21 PolarHBondContact O-N 3.07Å; Q19-G21 VanDerWaalsContact O-N 3.1Å; G21-R23 PolarHBondContact O-N 3Å; G21-R23 VanDerWaalsContact O-N 3.08Å
22	V	55.8	Low	49.1	Very low	131 Å²	131	166 Å²	166	79%	0.794	83%	0.828	S	S	*	*			trans	-65.7	103.8	168	179.8	0	0	0	0	107.4	V20	V20-V22 PolarHBondContact O-N 2.95Å
23	R	56.3	Low	49.5	Very low	223 Å²	223	166.8 Å²	166.8	84%	0.842	83%	0.833	S	S	*	*			trans	-56.5	127.9	171.7	-75.3	-178	171.2	-173	-2	108.6	G21 R25	G21-R23 PolarHBondContact O-N 3Å; G21-R23 VanDerWaalsContact O-N 3.08Å; R23-R25 PolarHBondContact O-N 3.1Å; R23-R25 VanDerWaalsContact O-N 3.09Å
24	P	53.9	Low	50	Low	122 Å²	122	160 Å²	160	79%	0.792	82%	0.815	S	S	*	*			trans	-63.1	118.4	176.8	24.7	-30.9	0	0	0	108.4	R26	P24-R26 PolarHBondContact O-N 3.03Å
25	R	59.1	Low	50.4	Low	242 Å²	242	165.3 Å²	165.3	91%	0.913	82%	0.822	S	S	*	*			trans	-61.1	103.9	169.9	-74.5	-174.3	171.3	-167.4	-2	107.3	R23	R23-R25 PolarHBondContact O-N 3.1Å; R23-R25 VanDerWaalsContact O-N 3.09Å
26	R	58.9	Low	51.5	Low	235 Å²	235	168 Å²	168	89%	0.887	82%	0.821	S	S	*	*			trans	-50.9	124.4	168.3	-94.2	-179.4	171.7	178.3	-2.1	107.8	P24 L28	P24-R26 PolarHBondContact O-N 3.03Å; R26-L28 PolarHBondContact O-N 3.04Å; R26-L28 VanDerWaalsContact O-N 3.11Å
27	P	55.5	Low	52.3	Low	122 Å²	122	163 Å²	163	79%	0.792	80%	0.803	S	S	*	*			trans	-61.3	120.8	170.7	23.6	-29.3	0	0	0	107.3	R29	P27-R29 PolarHBondContact O-N 3.39Å
28	L	59.6	Low	53.3	Low	168 Å²	168	163.1 Å²	163.1	88%	0.88	79%	0.792	S	S	*	*			trans	-53.1	105.9	168	-86.9	143.1	0	0	0	107.1	R26 R30	R26-L28 PolarHBondContact O-N 3.04Å; R26-L28 VanDerWaalsContact O-N 3.11Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.23Å
29	R	51.1	Low	54.5	Low	230 Å²	230	157 Å²	157	87%	0.868	78%	0.784	S	S	*	*			trans	-57.5	100.6	170.5	-175.5	177.9	178.2	-165.1	0.1	106.1	P27 Q31	P27-R29 PolarHBondContact O-N 3.39Å; R29-Q31 PolarHBondContact O-N 2.92Å
30	R	54	Low	55.6	Low	237 Å²	237	155 Å²	155	89%	0.894	77%	0.774	S	S	*	*			trans	-58.9	93.3	169.1	-82.2	-179.8	160	173.2	-4.5	106.6	L28	L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.23Å
31	Q	55.9	Low	57.1	Low	141 Å²	141	151.5 Å²	151.5	66%	0.659	75%	0.751	S	S	*	*			trans	-57.9	130.9	162.8	-66.6	-172.9	8.3	0	0	105.9	R29 T33	R29-Q31 PolarHBondContact O-N 2.92Å; Q31-T33 HydrophobicContact CB-CG2 4.49Å; Q31-T33 PolarHBondContact O-N 2.81Å
32	P	47.2	Very low	59	Low	125 Å²	125	150 Å²	150	81%	0.812	72%	0.724	S	S	*	*			trans	-67.8	86.8	169.7	28	-29.9	0	0	0	107.1	G34	P32-G34 PolarHBondContact O-N 3.16Å
33	T	50	Low	60.6	Low	139 Å²	139	148.9 Å²	148.9	85%	0.853	71%	0.705	S	S	*	*			trans	-73.3	63.5	168.4	44.6	0	0	0	0	108.8	Q31	Q31-T33 HydrophobicContact CB-CG2 4.49Å; Q31-T33 PolarHBondContact O-N 2.81Å
34	G	49.7	Very low	62.2	Low	50 Å²	50	144.3 Å²	144.3	52%	0.515	69%	0.691	S	S	.	*			trans	-142.9	98.8	167.7	0	0	0	0	0	106	P32 K36	P32-G34 PolarHBondContact O-N 3.16Å; G34-K36 PolarHBondContact O-N 3.07Å
35	K	54.5	Low	64	Low	199 Å²	199	138.9 Å²	138.9	87%	0.865	66%	0.655	S	S	*	*			trans	-44.9	114.5	154.4	-86.9	177.6	174.1	177.7	0	105	L37	K35-L37 VanDerWaalsContact C-N 3.3Å; K35-L37 PolarHBondContact O-N 3.22Å
36	K	54.4	Low	65.6	Low	203 Å²	203	131.6 Å²	131.6	88%	0.883	64%	0.64	S	S	*	*			trans	-55.6	105.4	171.3	-77.8	-175.9	177.8	-179.3	0	104.7	G34 K38	G34-K36 PolarHBondContact O-N 3.07Å; K36-K38 PolarHBondContact O-N 3.49Å
37	L	56.5	Low	67.1	Low	93 Å²	93	120.7 Å²	120.7	49%	0.487	60%	0.599	S	S	.	*			trans	-54.6	128.7	177.6	-67.5	166.9	0	0	0	106	K35	K35-L37 VanDerWaalsContact C-N 3.3Å; K35-L37 PolarHBondContact O-N 3.22Å
38	K	63.5	Low	68.8	Low	138 Å²	138	117.2 Å²	117.2	60%	0.6	58%	0.577	S	S	*	*			trans	-56.6	135.5	175.8	-69	-179.5	178.5	-177.5	0	107	K36 E40 D41	K36-K38 PolarHBondContact O-N 3.49Å; K38-E40 PolarHBondContact O-N 2.72Å; K38-D41 PolarHBondContact O-N 3.27Å; K38-D41 VanDerWaalsContact O-N 3.1Å
39	P	66.8	Low	70.3	Confident	111 Å²	111	112.3 Å²	112.3	72%	0.721	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-59.2	-20.8	-178.6	24.5	-33.6	0	0	0	112.4
40	E	69.4	Low	72.2	Confident	144 Å²	144	108.2 Å²	108.2	67%	0.673	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-68.4	-32.3	178.7	-63.7	173.6	177.5	0	0	113	K38 Y42 L97	K38-E40 PolarHBondContact O-N 2.72Å; E40-Y42 VanDerWaalsContact C-N 3.28Å; E40-Y42 PolarHBondContact O-N 3.45Å; E40-L97 WeakPolarHBondContact O-CD2 3.37Å
41	D	80.1	Confident	73.8	Confident	57 Å²	57	98.8 Å²	98.8	31%	0.305	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-90.4	7.2	-174.2	-59	-34.5	0	0	0	113.2	K38 L87	K38-D41 PolarHBondContact O-N 3.27Å; K38-D41 VanDerWaalsContact O-N 3.1Å; D41-L87 HydrophobicContact CB-CB 4.14Å; D41-L87 PolarHBondContact O-N 2.92Å
42	Y	86.2	Confident	75.4	Confident	41 Å²	41	94.7 Å²	94.7	16%	0.161	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	125.4	-164.5	-179.4	-108.3	0	0	0	113	E40 K44 E84 I85 R86	E40-Y42 VanDerWaalsContact C-N 3.28Å; E40-Y42 PolarHBondContact O-N 3.45Å; Y42-K44 HydrophobicContact CD1-CG 4.37Å; Y42-K44 HydrophobicContact CE1-CD 3.53Å; Y42-K44 HydrophobicContact CE1-CG 3.36Å; Y42-K44 WeakPolarHBondContact OH-CE 3.36Å; Y42-K44 VanDerWaalsContact OH-CG 3.29Å; Y42-K44 WeakPolarHBondContact OH-CG 3.42Å; Y42-E84 HydrophobicContact CE2-CB 3.87Å; Y42-E84 HydrophobicContact CE2-CG 4.33Å; Y42-E84 WeakPolarHBondContact OH-CG 3.44Å; Y42-E84 PolarHBondContact OH-OE1 3.41Å; Y42-E84 PolarHBondContact OH-OE2 3.32Å; Y42-I85 WeakPolarHBondContact CA-O 3.35Å; Y42-I85 WeakPolarHBondContact CD2-O 3.3Å; Y42-R86 HydrophobicContact CD2-CG 3.49Å; Y42-R86 VanDerWaalsContact CD2-CG 3.49Å; Y42-R86 HydrophobicContact CE2-CG 3.88Å
43	R	89.5	Confident	77.5	Confident	106 Å²	106	94.4 Å²	94.4	40%	0.4	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.8	176.5	-63.1	-63.4	-176.6	156.2	2.3	110.8	E84 I85 L97 A101	R43-E84 WeakPolarHBondContact O-CA 3.42Å; R43-I85 HydrophobicContact CB-CB 4.49Å; R43-I85 PolarHBondContact N-O 3.27Å; R43-I85 PolarHBondContact O-N 3.04Å; R43-L97 HydrophobicContact CB-CD1 4.26Å; R43-L97 HydrophobicContact CG-CD1 3.84Å; R43-L97 HydrophobicContact CG-CD2 3.94Å; R43-L97 HydrophobicContact CG-CG 3.67Å; R43-A101 HydrophobicContact CB-CB 4.44Å; R43-A101 HydrophobicContact CG-CB 4.4Å
44	K	91	Very high	79.5	Confident	127 Å²	127	89.2 Å²	89.2	55%	0.552	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	130	170.8	-80.1	168.7	167.6	168.6	0	108.8	Y42 V83 E84	Y42-K44 HydrophobicContact CD1-CG 4.37Å; Y42-K44 HydrophobicContact CE1-CD 3.53Å; Y42-K44 HydrophobicContact CE1-CG 3.36Å; Y42-K44 WeakPolarHBondContact OH-CE 3.36Å; Y42-K44 VanDerWaalsContact OH-CG 3.29Å; Y42-K44 WeakPolarHBondContact OH-CG 3.42Å; K44-V83 WeakPolarHBondContact CA-O 3.24Å; K44-E84 HydrophobicContact CG-CG 4.4Å
45	I	91.9	Very high	81.4	Confident	8 Å²	8	87 Å²	87	4%	0.041	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117	177.2	-58.2	164.7	0	0	0	108.1	N82 V83 I85 A101 V104 R105 V108	I45-N82 WeakPolarHBondContact O-CA 3.41Å; I45-V83 PolarHBondContact N-O 3.1Å; I45-V83 PolarHBondContact O-N 2.94Å; I45-I85 HydrophobicContact CD1-CD1 3.9Å; I45-A101 HydrophobicContact CD1-CB 3.97Å; I45-A101 WeakPolarHBondContact CD1-O 3.25Å; I45-V104 HydrophobicContact CB-CG1 4.24Å; I45-V104 HydrophobicContact CD1-CB 3.63Å; I45-V104 HydrophobicContact CD1-CG1 3.73Å; I45-V104 HydrophobicContact CG2-CG1 4.05Å; I45-R105 HydrophobicContact CD1-CG 4.47Å; I45-R105 HydrophobicContact CG2-CG 4.1Å; I45-V108 HydrophobicContact CG2-CG2 4.37Å
46	P	92	Very high	83.1	Confident	90 Å²	90	87.9 Å²	87.9	58%	0.584	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	135.3	177	30	-33.2	0	0	0	110.2	N82	P46-N82 WeakPolarHBondContact CA-OD1 3.46Å
47	V	91.1	Very high	84.9	Confident	6 Å²	6	85.3 Å²	85.3	4%	0.036	42%	0.419	C	S	.	.			trans	-107.9	127.2	177.5	-177.6	0	0	0	0	109.2	R51 Y52 L55 F76 R81 V83 V108	V47-R51 HydrophobicContact CG1-CB 4.02Å; V47-Y52 HydrophobicContact CB-CD1 4.22Å; V47-Y52 HydrophobicContact CB-CE1 3.77Å; V47-Y52 HydrophobicContact CG1-CD1 3.68Å; V47-Y52 HydrophobicContact CG1-CE1 3.66Å; V47-Y52 WeakPolarHBondContact O-CE1 3.06Å; V47-Y52 VanDerWaalsContact O-CZ 3.3Å; V47-Y52 PolarHBondContact O-OH 3.49Å; V47-L55 HydrophobicContact CG1-CD2 4.29Å; V47-L55 HydrophobicContact CG2-CD2 4.24Å; V47-F76 HydrophobicContact CG2-CE2 4.42Å; V47-R81 PolarHBondContact N-O 3.32Å; V47-R81 VanDerWaalsContact N-O 3.1Å; V47-V83 HydrophobicContact CG2-CG2 3.71Å; V47-V108 HydrophobicContact CB-CG2 4.43Å; V47-V108 HydrophobicContact CG1-CG2 4.32Å; V47-V108 HydrophobicContact CG2-CG2 3.86Å
48	P	90.7	Very high	86.5	Confident	49 Å²	49	83 Å²	83	32%	0.318	41%	0.408	S	S	.	.			trans	-66.4	154.7	173.7	-22.8	34.2	0	0	0	113.1	H50 R51 Y52 V108	P48-H50 VanDerWaalsContact C-N 3.34Å; P48-H50 VanDerWaalsContact CB-CE1 3.43Å; P48-H50 WeakPolarHBondContact CB-CE1 2.98Å; P48-H50 PolarHBondContact O-N 2.93Å; P48-R51 PolarHBondContact O-N 2.61Å; P48-R51 VanDerWaalsContact O-N 3.08Å; P48-Y52 VanDerWaalsContact O-CE1 3.31Å; P48-Y52 WeakPolarHBondContact O-CE1 3.32Å; P48-V108 HydrophobicContact CG-CG1 4.03Å
49	A	90.5	Very high	87.9	Confident	64 Å²	64	79.4 Å²	79.4	53%	0.529	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-60.9	-38	-174.9	0	0	0	0	0	114.9	R51 Y52	A49-R51 PolarHBondContact O-N 2.95Å; A49-R51 VanDerWaalsContact O-N 3.17Å; A49-Y52 HydrophobicContact CB-CD2 4.35Å; A49-Y52 HydrophobicContact CB-CE2 3.83Å; A49-Y52 WeakPolarHBondContact O-CD2 3.46Å; A49-Y52 PolarHBondContact O-N 3.48Å
50	H	90.3	Very high	89	Confident	144 Å²	144	78.4 Å²	78.4	67%	0.667	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-69.2	-9.9	179.6	67.3	-88.9	0	0	0	113.6	P48	P48-H50 VanDerWaalsContact C-N 3.34Å; P48-H50 VanDerWaalsContact CB-CE1 3.43Å; P48-H50 WeakPolarHBondContact CB-CE1 2.98Å; P48-H50 PolarHBondContact O-N 2.93Å
51	R	89.5	Confident	90.1	Very high	39 Å²	39	77.2 Å²	77.2	15%	0.147	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-104.9	-0.9	179.7	-63.3	-64.8	-70.9	166.8	-2.9	114.1	V47 P48 A49 P54 L55 F107	V47-R51 HydrophobicContact CG1-CB 4.02Å; P48-R51 PolarHBondContact O-N 2.61Å; P48-R51 VanDerWaalsContact O-N 3.08Å; A49-R51 PolarHBondContact O-N 2.95Å; A49-R51 VanDerWaalsContact O-N 3.17Å; R51-P54 WeakPolarHBondContact O-CD 3.43Å; R51-L55 VanDerWaalsContact O-CB 3.28Å; R51-L55 WeakPolarHBondContact O-CB 3.42Å; R51-L55 PolarHBondContact O-N 3.5Å; R51-F107 VanDerWaalsContact CZ-O 3.31Å; R51-F107 PolarHBondContact NE-O 3.08Å; R51-F107 VanDerWaalsContact NE-O 3.13Å; R51-F107 PolarHBondContact NH2-O 2.91Å
52	Y	88.7	Confident	90.6	Very high	56 Å²	56	74.6 Å²	74.6	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-41.6	-179.3	-62	-29	0	0	0	113.3	V47 P48 A49 L55 R56 F76 R81	V47-Y52 HydrophobicContact CB-CD1 4.22Å; V47-Y52 HydrophobicContact CB-CE1 3.77Å; V47-Y52 HydrophobicContact CG1-CD1 3.68Å; V47-Y52 HydrophobicContact CG1-CE1 3.66Å; V47-Y52 WeakPolarHBondContact O-CE1 3.06Å; V47-Y52 VanDerWaalsContact O-CZ 3.3Å; V47-Y52 PolarHBondContact O-OH 3.49Å; P48-Y52 VanDerWaalsContact O-CE1 3.31Å; P48-Y52 WeakPolarHBondContact O-CE1 3.32Å; A49-Y52 HydrophobicContact CB-CD2 4.35Å; A49-Y52 HydrophobicContact CB-CE2 3.83Å; A49-Y52 WeakPolarHBondContact O-CD2 3.46Å; A49-Y52 PolarHBondContact O-N 3.48Å; Y52-L55 PolarHBondContact O-N 3.21Å; Y52-R56 PolarHBondContact O-N 3.49Å; Y52-F76 HydrophobicContact CD1-CZ 4.33Å; Y52-R81 HydrophobicContact CE1-CB 4.21Å; Y52-R81 WeakPolarHBondContact OH-CB 3.02Å; Y52-R81 WeakPolarHBondContact OH-CD 3.24Å
53	N	90.9	Very high	90.9	Very high	118 Å²	118	76.9 Å²	76.9	63%	0.631	37%	0.37	S	S	*	.	H	α-helix	trans	-65.5	-51.7	179.2	-66.7	-11.2	0	0	0	111.5	L55 R56 E57	N53-L55 VanDerWaalsContact C-N 3.26Å; N53-L55 PolarHBondContact O-N 3.43Å; N53-R56 PolarHBondContact O-N 3.44Å; N53-R56 VanDerWaalsContact O-N 3.09Å; N53-E57 WeakPolarHBondContact O-CG 3.31Å; N53-E57 PolarHBondContact O-N 3.28Å
54	P	91.8	Very high	91	Very high	31 Å²	31	73.3 Å²	73.3	20%	0.201	36%	0.361	C	S	.	.	H	α-helix	trans	-57.2	-36.6	174.4	-26.8	33.4	0	0	0	113.9	R51 N58 F107	R51-P54 WeakPolarHBondContact O-CD 3.43Å; P54-N58 WeakPolarHBondContact O-CB 3.25Å; P54-N58 PolarHBondContact O-N 3.19Å; P54-N58 PolarHBondContact O-ND2 3.32Å; P54-F107 HydrophobicContact CB-CZ 3.94Å
55	L	90.7	Very high	91	Very high	4 Å²	4	67.6 Å²	67.6	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-41.5	177.7	-174.3	72	0	0	0	111.3	V47 R51 Y52 N53 W59 I62 F76 V83 F107	V47-L55 HydrophobicContact CG1-CD2 4.29Å; V47-L55 HydrophobicContact CG2-CD2 4.24Å; R51-L55 VanDerWaalsContact O-CB 3.28Å; R51-L55 WeakPolarHBondContact O-CB 3.42Å; R51-L55 PolarHBondContact O-N 3.5Å; Y52-L55 PolarHBondContact O-N 3.21Å; N53-L55 VanDerWaalsContact C-N 3.26Å; N53-L55 PolarHBondContact O-N 3.43Å; L55-W59 HydrophobicContact CD1-CE3 4.07Å; L55-W59 HydrophobicContact CD1-CZ3 4.11Å; L55-W59 HydrophobicContact CD2-CZ3 4.44Å; L55-W59 HydrophobicContact CG-CE3 4.05Å; L55-W59 HydrophobicContact CG-CZ3 4.27Å; L55-W59 VanDerWaalsContact O-CA 3.28Å; L55-W59 WeakPolarHBondContact O-CA 3.41Å; L55-W59 WeakPolarHBondContact O-CB 3.49Å; L55-W59 PolarHBondContact O-N 2.84Å; L55-I62 HydrophobicContact CD1-CD1 3.75Å; L55-F76 HydrophobicContact CD2-CD2 3.84Å; L55-F76 HydrophobicContact CD2-CE2 3.69Å; L55-F76 HydrophobicContact CD2-CG 4.38Å; L55-F76 HydrophobicContact CD2-CZ 4.11Å; L55-V83 HydrophobicContact CD2-CG2 4.15Å; L55-F107 HydrophobicContact CB-CE1 3.89Å; L55-F107 HydrophobicContact CD1-CD1 3.85Å; L55-F107 HydrophobicContact CD1-CE1 3.61Å; L55-F107 HydrophobicContact CG-CE1 4.39Å
56	R	89.3	Confident	91	Very high	216 Å²	216	67.2 Å²	67.2	82%	0.815	33%	0.334	S	S	*	.	H	α-helix	trans	-69.9	-43.8	-179.8	-169.6	-179.7	-175.9	173.5	0.4	111.7	Y52 N53	Y52-R56 PolarHBondContact O-N 3.49Å; N53-R56 PolarHBondContact O-N 3.44Å; N53-R56 VanDerWaalsContact O-N 3.09Å
57	E	92.4	Very high	90.9	Very high	149 Å²	149	66.2 Å²	66.2	70%	0.696	33%	0.327	S	S	*	.	H	α-helix	trans	-64.2	-42.6	178.9	-72	169.5	-168.3	0	0	112.1	N53	N53-E57 WeakPolarHBondContact O-CG 3.31Å; N53-E57 PolarHBondContact O-N 3.28Å
58	N	91.2	Very high	90.8	Very high	45 Å²	45	71.9 Å²	71.9	24%	0.241	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	10.6	-177.6	-63	-68.4	0	0	0	113.8	P54 V60 K61 I62 V113	P54-N58 WeakPolarHBondContact O-CB 3.25Å; P54-N58 PolarHBondContact O-N 3.19Å; P54-N58 PolarHBondContact O-ND2 3.32Å; N58-V60 PolarHBondContact O-N 3.37Å; N58-V60 VanDerWaalsContact O-N 3.13Å; N58-K61 PolarHBondContact O-N 3.15Å; N58-I62 HydrophobicContact CB-CD1 4.39Å; N58-I62 WeakPolarHBondContact O-CG1 3.32Å; N58-I62 PolarHBondContact O-N 2.87Å; N58-I62 VanDerWaalsContact O-N 3.14Å; N58-V113 HydrophobicContact CB-CG2 3.84Å
59	W	91.1	Very high	90.6	Very high	62 Å²	62	75.9 Å²	75.9	24%	0.235	37%	0.367	C	S	.	.	H	α-helix	trans	-54	-41.1	-174.1	-175.1	-111.2	0	0	0	111.8	L55 K61 I62 Y63 I74 F76 V83	L55-W59 HydrophobicContact CD1-CE3 4.07Å; L55-W59 HydrophobicContact CD1-CZ3 4.11Å; L55-W59 HydrophobicContact CD2-CZ3 4.44Å; L55-W59 HydrophobicContact CG-CE3 4.05Å; L55-W59 HydrophobicContact CG-CZ3 4.27Å; L55-W59 VanDerWaalsContact O-CA 3.28Å; L55-W59 WeakPolarHBondContact O-CA 3.41Å; L55-W59 WeakPolarHBondContact O-CB 3.49Å; L55-W59 PolarHBondContact O-N 2.84Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 2.71Å; W59-I62 PolarHBondContact O-N 2.84Å; W59-I62 VanDerWaalsContact O-N 3.09Å; W59-Y63 AromaticContact CD1-CD1 3.51Å; W59-Y63 HydrophobicContact CG-CD1 4.19Å; W59-Y63 AromaticContact NE1-CD1 3.59Å; W59-Y63 WeakPolarHBondContact O-CD1 3.32Å; W59-Y63 PolarHBondContact O-N 2.79Å; W59-I74 HydrophobicContact CH2-CD1 3.78Å; W59-I74 HydrophobicContact CH2-CG1 3.8Å; W59-I74 HydrophobicContact CZ2-CD1 4.44Å; W59-I74 HydrophobicContact CZ2-CG1 4.23Å; W59-I74 HydrophobicContact CZ2-CG2 4.46Å; W59-I74 HydrophobicContact CZ3-CD1 4.34Å; W59-F76 HydrophobicContact CH2-CB 3.8Å; W59-F76 HydrophobicContact CZ2-CB 4.25Å; W59-F76 HydrophobicContact CZ3-CB 4.16Å; W59-V83 HydrophobicContact CZ3-CG2 4.47Å
60	V	91.5	Very high	90.4	Very high	91 Å²	91	73.2 Å²	73.2	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-57.4	-45.9	178.5	-175.8	0	0	0	0	112.5	N58 I62 Y63 S64	N58-V60 PolarHBondContact O-N 3.37Å; N58-V60 VanDerWaalsContact O-N 3.13Å; V60-I62 VanDerWaalsContact C-N 3.26Å; V60-I62 PolarHBondContact O-N 2.77Å; V60-Y63 HydrophobicContact CB-CE1 4.06Å; V60-Y63 HydrophobicContact CG1-CE1 4.17Å; V60-Y63 HydrophobicContact CG2-CE1 4.06Å; V60-S64 VanDerWaalsContact O-CB 3.3Å; V60-S64 WeakPolarHBondContact O-CB 3.41Å; V60-S64 PolarHBondContact O-N 2.84Å
61	K	91.4	Very high	90.3	Very high	119 Å²	119	70.4 Å²	70.4	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-24.5	178.9	-61	-177	176.1	-176.7	0	112.8	N58 W59 P65 V113	N58-K61 PolarHBondContact O-N 3.15Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 2.71Å; K61-P65 WeakPolarHBondContact O-CD 3.37Å; K61-P65 WeakPolarHBondContact O-CG 3.43Å; K61-V113 HydrophobicContact CB-CG1 3.84Å
62	I	91.8	Very high	90.4	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-84.1	-46.8	-179.7	-65.1	168.4	0	0	0	110.8	L55 N58 W59 V60 P65 I66 F103 V104 F107 V113	L55-I62 HydrophobicContact CD1-CD1 3.75Å; N58-I62 HydrophobicContact CB-CD1 4.39Å; N58-I62 WeakPolarHBondContact O-CG1 3.32Å; N58-I62 PolarHBondContact O-N 2.87Å; N58-I62 VanDerWaalsContact O-N 3.14Å; W59-I62 PolarHBondContact O-N 2.84Å; W59-I62 VanDerWaalsContact O-N 3.09Å; V60-I62 VanDerWaalsContact C-N 3.26Å; V60-I62 PolarHBondContact O-N 2.77Å; I62-P65 WeakPolarHBondContact O-CD 3.42Å; I62-I66 HydrophobicContact CG2-CD1 4.15Å; I62-I66 VanDerWaalsContact O-CD1 3.31Å; I62-I66 WeakPolarHBondContact O-CD1 3.26Å; I62-I66 WeakPolarHBondContact O-CG1 3.44Å; I62-F103 HydrophobicContact CB-CE1 4.28Å; I62-F103 HydrophobicContact CG2-CE1 3.8Å; I62-V104 HydrophobicContact CG2-CG2 4.47Å; I62-F107 HydrophobicContact CD1-CD1 3.84Å; I62-F107 HydrophobicContact CD1-CD2 4.04Å; I62-F107 HydrophobicContact CD1-CE1 3.79Å; I62-F107 HydrophobicContact CD1-CE2 3.98Å; I62-F107 HydrophobicContact CD1-CG 3.96Å; I62-F107 HydrophobicContact CD1-CZ 3.85Å; I62-V113 HydrophobicContact CG1-CG1 4.25Å; I62-V113 HydrophobicContact CG1-CG2 4.36Å
63	Y	91.4	Very high	90.5	Very high	90 Å²	90	70.8 Å²	70.8	35%	0.353	34%	0.335	S	S	.	.	H	α-helix	trans	-74.8	-33.8	-176.4	82.1	-108.5	0	0	0	112.6	W59 V60 I66 V67	W59-Y63 AromaticContact CD1-CD1 3.51Å; W59-Y63 HydrophobicContact CG-CD1 4.19Å; W59-Y63 AromaticContact NE1-CD1 3.59Å; W59-Y63 WeakPolarHBondContact O-CD1 3.32Å; W59-Y63 PolarHBondContact O-N 2.79Å; V60-Y63 HydrophobicContact CB-CE1 4.06Å; V60-Y63 HydrophobicContact CG1-CE1 4.17Å; V60-Y63 HydrophobicContact CG2-CE1 4.06Å; Y63-I66 PolarHBondContact O-N 3.38Å; Y63-V67 HydrophobicContact CD2-CG2 4.3Å; Y63-V67 WeakPolarHBondContact O-CG2 3.27Å; Y63-V67 PolarHBondContact O-N 2.93Å
64	S	92	Very high	90.5	Very high	31 Å²	31	66.2 Å²	66.2	22%	0.217	31%	0.31	C	S	.	.	H	α-helix	trans	-53.1	-56	-178.5	165.9	0	0	0	0	112.8	V60 I66 V67 E68	V60-S64 VanDerWaalsContact O-CB 3.3Å; V60-S64 WeakPolarHBondContact O-CB 3.41Å; V60-S64 PolarHBondContact O-N 2.84Å; S64-I66 VanDerWaalsContact C-N 3.28Å; S64-I66 PolarHBondContact O-N 2.83Å; S64-V67 PolarHBondContact O-N 3.44Å; S64-E68 VanDerWaalsContact O-CB 3.25Å; S64-E68 WeakPolarHBondContact O-CB 3.31Å; S64-E68 WeakPolarHBondContact O-CG 3.47Å; S64-E68 PolarHBondContact O-N 3.37Å; S64-E68 VanDerWaalsContact OG-CD 3.28Å; S64-E68 PolarHBondContact OG-OE1 3.26Å
65	P	91.1	Very high	90.5	Very high	6 Å²	6	72.4 Å²	72.4	4%	0.039	33%	0.33	C	S	.	.	H	α-helix	trans	-65.6	-29.6	179.5	25.1	-34.6	0	0	0	113.3	K61 I62 H69 L70 F103 L117	K61-P65 WeakPolarHBondContact O-CD 3.37Å; K61-P65 WeakPolarHBondContact O-CG 3.43Å; I62-P65 WeakPolarHBondContact O-CD 3.42Å; P65-H69 VanDerWaalsContact O-CB 3.31Å; P65-H69 WeakPolarHBondContact O-CB 3.34Å; P65-H69 PolarHBondContact O-N 2.89Å; P65-H69 VanDerWaalsContact O-N 3.15Å; P65-L70 PolarHBondContact O-N 3.27Å; P65-F103 HydrophobicContact CG-CE1 4.2Å; P65-F103 HydrophobicContact CG-CZ 4.23Å; P65-L117 HydrophobicContact CB-CD1 4.44Å; P65-L117 HydrophobicContact CG-CD1 4.43Å
66	I	90.8	Very high	90.5	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-72.2	-40.2	179.1	-62.9	172.6	0	0	0	111.2	I62 Y63 S64 L70 K71 L72 I74 A100 F103 V104	I62-I66 HydrophobicContact CG2-CD1 4.15Å; I62-I66 VanDerWaalsContact O-CD1 3.31Å; I62-I66 WeakPolarHBondContact O-CD1 3.26Å; I62-I66 WeakPolarHBondContact O-CG1 3.44Å; Y63-I66 PolarHBondContact O-N 3.38Å; S64-I66 VanDerWaalsContact C-N 3.28Å; S64-I66 PolarHBondContact O-N 2.83Å; I66-L70 CarbonylContact O-C 3.52Å; I66-L70 VanDerWaalsContact O-CB 3.32Å; I66-L70 WeakPolarHBondContact O-CB 3.35Å; I66-L70 PolarHBondContact O-N 3.42Å; I66-K71 PolarHBondContact O-N 2.86Å; I66-L72 HydrophobicContact CG2-CB 3.82Å; I66-L72 HydrophobicContact CG2-CD1 4.36Å; I66-L72 PolarHBondContact O-N 3.41Å; I66-I74 HydrophobicContact CD1-CD1 3.54Å; I66-I74 HydrophobicContact CG2-CB 4.36Å; I66-A100 HydrophobicContact CG1-CB 4.47Å; I66-A100 HydrophobicContact CG2-CB 4.25Å; I66-F103 HydrophobicContact CD1-CD1 3.82Å; I66-F103 HydrophobicContact CD1-CE1 4.05Å; I66-F103 HydrophobicContact CG1-CD1 3.96Å; I66-F103 HydrophobicContact CG1-CE1 4.16Å; I66-V104 HydrophobicContact CD1-CG2 3.97Å
67	V	90.7	Very high	90.5	Very high	69 Å²	69	67.8 Å²	67.8	42%	0.418	32%	0.318	S	S	.	.	H	α-helix	trans	-81.5	-45.5	-178.6	177.6	0	0	0	0	110.4	Y63 S64 K71 I74	Y63-V67 HydrophobicContact CD2-CG2 4.3Å; Y63-V67 WeakPolarHBondContact O-CG2 3.27Å; Y63-V67 PolarHBondContact O-N 2.93Å; S64-V67 PolarHBondContact O-N 3.44Å; V67-K71 VanDerWaalsContact O-CA 3.24Å; V67-K71 WeakPolarHBondContact O-CA 3.45Å; V67-K71 PolarHBondContact O-N 3.05Å; V67-I74 HydrophobicContact CG2-CG2 4.17Å
68	E	88.8	Confident	90.3	Very high	126 Å²	126	65.9 Å²	65.9	59%	0.589	32%	0.317	S	S	*	.	H	α-helix	trans	-75.4	-47.8	-174.1	-67.3	170.4	-146.4	0	0	112.8	S64	S64-E68 VanDerWaalsContact O-CB 3.25Å; S64-E68 WeakPolarHBondContact O-CB 3.31Å; S64-E68 WeakPolarHBondContact O-CG 3.47Å; S64-E68 PolarHBondContact O-N 3.37Å; S64-E68 VanDerWaalsContact OG-CD 3.28Å; S64-E68 PolarHBondContact OG-OE1 3.26Å
69	H	86.7	Confident	90.1	Very high	132 Å²	132	75.1 Å²	75.1	61%	0.611	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-39.3	-175.9	-56.3	-49.8	0	0	0	112.7	P65	P65-H69 VanDerWaalsContact O-CB 3.31Å; P65-H69 WeakPolarHBondContact O-CB 3.34Å; P65-H69 PolarHBondContact O-N 2.89Å; P65-H69 VanDerWaalsContact O-N 3.15Å
70	L	86.5	Confident	89.9	Confident	9 Å²	9	74.6 Å²	74.6	5%	0.047	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-10.7	-174.3	-57.2	174.2	0	0	0	113.2	P65 I66 L72 T91 N96 A100 V120	P65-L70 PolarHBondContact O-N 3.27Å; I66-L70 CarbonylContact O-C 3.52Å; I66-L70 VanDerWaalsContact O-CB 3.32Å; I66-L70 WeakPolarHBondContact O-CB 3.35Å; I66-L70 PolarHBondContact O-N 3.42Å; L70-L72 HydrophobicContact CB-CD1 3.86Å; L70-L72 HydrophobicContact CB-CG 3.97Å; L70-L72 HydrophobicContact CD1-CD1 4.29Å; L70-L72 PolarHBondContact O-N 3.04Å; L70-T91 WeakPolarHBondContact O-CG2 3.29Å; L70-N96 HydrophobicContact CB-CB 4.14Å; L70-N96 HydrophobicContact CD2-CB 3.8Å; L70-N96 HydrophobicContact CG-CB 4.46Å; L70-A100 HydrophobicContact CD1-CB 3.79Å; L70-V120 HydrophobicContact CD1-CG1 4.2Å; L70-V120 HydrophobicContact CD2-CG1 4.29Å; L70-V120 HydrophobicContact CG-CG1 4.32Å
71	K	89	Confident	89.7	Confident	85 Å²	85	76.8 Å²	76.8	37%	0.37	35%	0.352	S	S	.	.			trans	55	32.6	-177	-56.6	177.1	-173.9	164.6	0	113.6	I66 V67 S88 E90 T91 D92	I66-K71 PolarHBondContact O-N 2.86Å; V67-K71 VanDerWaalsContact O-CA 3.24Å; V67-K71 WeakPolarHBondContact O-CA 3.45Å; V67-K71 PolarHBondContact O-N 3.05Å; K71-S88 WeakPolarHBondContact O-CB 3.47Å; K71-E90 VanDerWaalsContact CD-O 3.24Å; K71-E90 WeakPolarHBondContact CD-O 3.5Å; K71-T91 PolarHBondContact O-OG1 3.08Å; K71-T91 VanDerWaalsContact O-OG1 3.07Å; K71-D92 IonicContact NZ-OD2 2.68Å; K71-D92 PolarHBondContact NZ-OD2 3Å
72	L	91.2	Very high	89.7	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.016	34%	0.337	C	S	.	.			trans	-97.9	152.5	-178.1	-65	172.1	0	0	0	112	I66 L70 I85 L87 T91 N96 A100	I66-L72 HydrophobicContact CG2-CB 3.82Å; I66-L72 HydrophobicContact CG2-CD1 4.36Å; I66-L72 PolarHBondContact O-N 3.41Å; L70-L72 HydrophobicContact CB-CD1 3.86Å; L70-L72 HydrophobicContact CB-CG 3.97Å; L70-L72 HydrophobicContact CD1-CD1 4.29Å; L70-L72 PolarHBondContact O-N 3.04Å; L72-I85 HydrophobicContact CB-CG2 4.2Å; L72-I85 HydrophobicContact CD1-CG2 4.06Å; L72-L87 HydrophobicContact CD2-CD1 3.68Å; L72-T91 HydrophobicContact CD2-CG2 4.08Å; L72-N96 HydrophobicContact CD1-CB 4.4Å; L72-N96 WeakPolarHBondContact CD1-O 3.41Å; L72-A100 HydrophobicContact CD1-CB 3.46Å; L72-A100 VanDerWaalsContact CD1-CB 3.46Å
73	Q	90.1	Very high	89.8	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122.8	171.9	-66.7	-177.5	0.5	0	0	109.9	I85 R86	Q73-I85 CarbonylContact O-C 3.5Å; Q73-I85 WeakPolarHBondContact O-CA 3.35Å; Q73-R86 HydrophobicContact CB-CB 4.11Å; Q73-R86 PolarHBondContact N-O 3.2Å; Q73-R86 PolarHBondContact O-N 3.18Å
74	I	91.9	Very high	89.8	Confident	22 Å²	22	69.5 Å²	69.5	11%	0.113	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.5	177	-173.6	169.1	0	0	0	111.1	W59 I66 V67 V83 E84 I85 V104	W59-I74 HydrophobicContact CH2-CD1 3.78Å; W59-I74 HydrophobicContact CH2-CG1 3.8Å; W59-I74 HydrophobicContact CZ2-CD1 4.44Å; W59-I74 HydrophobicContact CZ2-CG1 4.23Å; W59-I74 HydrophobicContact CZ2-CG2 4.46Å; W59-I74 HydrophobicContact CZ3-CD1 4.34Å; I66-I74 HydrophobicContact CD1-CD1 3.54Å; I66-I74 HydrophobicContact CG2-CB 4.36Å; V67-I74 HydrophobicContact CG2-CG2 4.17Å; I74-V83 HydrophobicContact CD1-CG1 3.69Å; I74-V83 HydrophobicContact CG1-CG1 3.82Å; I74-E84 CarbonylContact C-O 3.6Å; I74-E84 WeakPolarHBondContact CA-O 3.35Å; I74-I85 HydrophobicContact CG1-CG1 4.42Å; I74-V104 HydrophobicContact CD1-CG2 4.39Å
75	R	91.2	Very high	89.8	Confident	162 Å²	162	68 Å²	68	61%	0.611	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.8	174.6	-65.2	-177	66.8	176.8	0.7	110.2	E84	R75-E84 PolarHBondContact N-O 3.29Å; R75-E84 PolarHBondContact O-N 3.26Å
76	F	90.8	Very high	89.7	Confident	66 Å²	66	71.3 Å²	71.3	29%	0.289	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.3	168.3	-177.1	-117.1	0	0	0	109.9	V47 Y52 L55 W59 T78 V83	V47-F76 HydrophobicContact CG2-CE2 4.42Å; Y52-F76 HydrophobicContact CD1-CZ 4.33Å; L55-F76 HydrophobicContact CD2-CD2 3.84Å; L55-F76 HydrophobicContact CD2-CE2 3.69Å; L55-F76 HydrophobicContact CD2-CG 4.38Å; L55-F76 HydrophobicContact CD2-CZ 4.11Å; W59-F76 HydrophobicContact CH2-CB 3.8Å; W59-F76 HydrophobicContact CZ2-CB 4.25Å; W59-F76 HydrophobicContact CZ3-CB 4.16Å; F76-T78 HydrophobicContact CE1-CG2 4.47Å; F76-V83 HydrophobicContact CD2-CG2 3.74Å; F76-V83 HydrophobicContact CE2-CG2 4.31Å
77	N	90	Very high	89.5	Confident	57 Å²	57	73.5 Å²	73.5	31%	0.305	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	101.8	174.6	-173.8	-14.2	0	0	0	109.5	R79 S80 R81 N82 E84	N77-R79 PolarHBondContact O-N 2.8Å; N77-R79 PolarHBondContact OD1-N 3.29Å; N77-R79 VanDerWaalsContact OD1-N 3.13Å; N77-S80 WeakPolarHBondContact CB-OG 3.41Å; N77-S80 VanDerWaalsContact CG-OG 3.24Å; N77-S80 PolarHBondContact ND2-OG 2.94Å; N77-S80 PolarHBondContact O-N 3.43Å; N77-S80 PolarHBondContact OD1-N 3.49Å; N77-R81 WeakPolarHBondContact O-CA 3.26Å; N77-R81 PolarHBondContact O-N 2.96Å; N77-N82 PolarHBondContact N-O 3.4Å; N77-N82 PolarHBondContact O-N 3.19Å; N77-E84 PolarHBondContact ND2-OE1 2.89Å
78	T	86.5	Confident	89	Confident	109 Å²	109	70.8 Å²	70.8	67%	0.669	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.5	-178.3	-42.2	0	0	0	0	113	F76	F76-T78 HydrophobicContact CE1-CG2 4.47Å
79	R	88	Confident	88.4	Confident	239 Å²	239	71 Å²	71	90%	0.902	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-49.5	-180	-67.8	-175.4	177	-173	-2.3	111.8	N77 R81	N77-R79 PolarHBondContact O-N 2.8Å; N77-R79 PolarHBondContact OD1-N 3.29Å; N77-R79 VanDerWaalsContact OD1-N 3.13Å; R79-R81 VanDerWaalsContact C-N 3.3Å
80	S	86.4	Confident	87.8	Confident	50 Å²	50	71.3 Å²	71.3	35%	0.35	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.8	179.4	70.3	0	0	0	0	113.3	N77 N82	N77-S80 WeakPolarHBondContact CB-OG 3.41Å; N77-S80 VanDerWaalsContact CG-OG 3.24Å; N77-S80 PolarHBondContact ND2-OG 2.94Å; N77-S80 PolarHBondContact O-N 3.43Å; N77-S80 PolarHBondContact OD1-N 3.49Å; S80-N82 VanDerWaalsContact O-CG 3.26Å; S80-N82 PolarHBondContact O-N 3.4Å; S80-N82 PolarHBondContact O-ND2 3.1Å; S80-N82 PolarHBondContact O-OD1 3.23Å; S80-N82 PolarHBondContact OG-ND2 2.98Å
81	R	88	Confident	87.1	Confident	137 Å²	137	71.8 Å²	71.8	52%	0.517	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	34.8	-179.1	-46.9	-173	-168.9	172.2	-6.2	113.4	V47 Y52 N77 R79	V47-R81 PolarHBondContact N-O 3.32Å; V47-R81 VanDerWaalsContact N-O 3.1Å; Y52-R81 HydrophobicContact CE1-CB 4.21Å; Y52-R81 WeakPolarHBondContact OH-CB 3.02Å; Y52-R81 WeakPolarHBondContact OH-CD 3.24Å; N77-R81 WeakPolarHBondContact O-CA 3.26Å; N77-R81 PolarHBondContact O-N 2.96Å; R79-R81 VanDerWaalsContact C-N 3.3Å
82	N	91.4	Very high	86.3	Confident	36 Å²	36	73.5 Å²	73.5	19%	0.193	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.6	-178.3	-62.5	-31.4	0	0	0	110.1	I45 P46 N77 S80	I45-N82 WeakPolarHBondContact O-CA 3.41Å; P46-N82 WeakPolarHBondContact CA-OD1 3.46Å; N77-N82 PolarHBondContact N-O 3.4Å; N77-N82 PolarHBondContact O-N 3.19Å; S80-N82 VanDerWaalsContact O-CG 3.26Å; S80-N82 PolarHBondContact O-N 3.4Å; S80-N82 PolarHBondContact O-ND2 3.1Å; S80-N82 PolarHBondContact O-OD1 3.23Å; S80-N82 PolarHBondContact OG-ND2 2.98Å
83	V	92.4	Very high	85.8	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.006	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.7	161.9	178.1	0	0	0	0	107.3	K44 I45 V47 L55 W59 I74 F76 I85 V104	K44-V83 WeakPolarHBondContact CA-O 3.24Å; I45-V83 PolarHBondContact N-O 3.1Å; I45-V83 PolarHBondContact O-N 2.94Å; V47-V83 HydrophobicContact CG2-CG2 3.71Å; L55-V83 HydrophobicContact CD2-CG2 4.15Å; W59-V83 HydrophobicContact CZ3-CG2 4.47Å; I74-V83 HydrophobicContact CD1-CG1 3.69Å; I74-V83 HydrophobicContact CG1-CG1 3.82Å; F76-V83 HydrophobicContact CD2-CG2 3.74Å; F76-V83 HydrophobicContact CE2-CG2 4.31Å; V83-I85 HydrophobicContact CG1-CG1 4.26Å; V83-V104 HydrophobicContact CB-CG1 4.08Å; V83-V104 HydrophobicContact CG1-CG1 4.06Å; V83-V104 HydrophobicContact CG1-CG2 4.44Å; V83-V104 HydrophobicContact CG2-CG1 4.16Å
84	E	91.6	Very high	85.5	Confident	21 Å²	21	79.2 Å²	79.2	10%	0.098	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123	-179.8	-60.1	-168.3	-172.2	0	0	108.8	Y42 R43 K44 I74 R75 N77 R86	Y42-E84 HydrophobicContact CE2-CB 3.87Å; Y42-E84 HydrophobicContact CE2-CG 4.33Å; Y42-E84 WeakPolarHBondContact OH-CG 3.44Å; Y42-E84 PolarHBondContact OH-OE1 3.41Å; Y42-E84 PolarHBondContact OH-OE2 3.32Å; R43-E84 WeakPolarHBondContact O-CA 3.42Å; K44-E84 HydrophobicContact CG-CG 4.4Å; I74-E84 CarbonylContact C-O 3.6Å; I74-E84 WeakPolarHBondContact CA-O 3.35Å; R75-E84 PolarHBondContact N-O 3.29Å; R75-E84 PolarHBondContact O-N 3.26Å; N77-E84 PolarHBondContact ND2-OE1 2.89Å; E84-R86 IonicContact OE2-NH2 2.85Å; E84-R86 PolarHBondContact OE2-NH2 2.94Å
85	I	92.2	Very high	85.3	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.7	177.1	-49.3	173.8	0	0	0	107.6	Y42 R43 I45 L72 Q73 I74 V83 L97 A100 V104	Y42-I85 WeakPolarHBondContact CA-O 3.35Å; Y42-I85 WeakPolarHBondContact CD2-O 3.3Å; R43-I85 HydrophobicContact CB-CB 4.49Å; R43-I85 PolarHBondContact N-O 3.27Å; R43-I85 PolarHBondContact O-N 3.04Å; I45-I85 HydrophobicContact CD1-CD1 3.9Å; L72-I85 HydrophobicContact CB-CG2 4.2Å; L72-I85 HydrophobicContact CD1-CG2 4.06Å; Q73-I85 CarbonylContact O-C 3.5Å; Q73-I85 WeakPolarHBondContact O-CA 3.35Å; I74-I85 HydrophobicContact CG1-CG1 4.42Å; V83-I85 HydrophobicContact CG1-CG1 4.26Å; I85-L97 HydrophobicContact CB-CD1 4.07Å; I85-L97 HydrophobicContact CG2-CD1 3.62Å; I85-A100 HydrophobicContact CD1-CB 4.06Å; I85-A100 HydrophobicContact CG2-CB 4.33Å; I85-V104 HydrophobicContact CD1-CG2 4.11Å
86	R	89.1	Confident	85.1	Confident	74 Å²	74	78 Å²	78	28%	0.279	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.7	-179.9	-74.6	173.5	-169.5	-168.9	4.5	109.7	Y42 Q73 E84 S88	Y42-R86 HydrophobicContact CD2-CG 3.49Å; Y42-R86 VanDerWaalsContact CD2-CG 3.49Å; Y42-R86 HydrophobicContact CE2-CG 3.88Å; Q73-R86 HydrophobicContact CB-CB 4.11Å; Q73-R86 PolarHBondContact N-O 3.2Å; Q73-R86 PolarHBondContact O-N 3.18Å; E84-R86 IonicContact OE2-NH2 2.85Å; E84-R86 PolarHBondContact OE2-NH2 2.94Å; R86-S88 PolarHBondContact O-N 3.1Å
87	L	87.2	Confident	85.1	Confident	46 Å²	46	75 Å²	75	24%	0.241	37%	0.373	C	S	.	.			trans	-66.4	129.2	167.6	-160.1	69.3	0	0	0	109.6	D41 L72 T91	D41-L87 HydrophobicContact CB-CB 4.14Å; D41-L87 PolarHBondContact O-N 2.92Å; L72-L87 HydrophobicContact CD2-CD1 3.68Å; L87-T91 HydrophobicContact CD1-CG2 3.64Å
88	S	80.9	Confident	85.1	Confident	13 Å²	13	75.7 Å²	75.7	9%	0.091	38%	0.375	C	S	.	.			trans	-84.6	147.7	167.6	-166.1	0	0	0	0	108.5	K71 R86 E90 T91	K71-S88 WeakPolarHBondContact O-CB 3.47Å; R86-S88 PolarHBondContact O-N 3.1Å; S88-E90 PolarHBondContact O-N 3.11Å; S88-T91 PolarHBondContact N-OG1 2.9Å; S88-T91 WeakPolarHBondContact O-CB 2.95Å; S88-T91 PolarHBondContact O-N 3.09Å; S88-T91 PolarHBondContact O-OG1 2.64Å
89	P	75.7	Confident	85.3	Confident	131 Å²	131	72.6 Å²	72.6	85%	0.851	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-17.1	172.6	25	-36.2	0	0	0	113.8	T91	P89-T91 VanDerWaalsContact C-N 3.31Å
90	E	74.7	Confident	85.5	Confident	137 Å²	137	61.2 Å²	61.2	64%	0.64	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.6	177.5	-61.4	174.5	-175.2	0	0	113.8	K71 S88	K71-E90 VanDerWaalsContact CD-O 3.24Å; K71-E90 WeakPolarHBondContact CD-O 3.5Å; S88-E90 PolarHBondContact O-N 3.11Å
91	T	71.6	Confident	85.8	Confident	20 Å²	20	58.9 Å²	58.9	12%	0.123	29%	0.293	C	S	.	.			trans	-83.3	123.6	-176.3	-45.7	0	0	0	0	110.5	L70 K71 L72 L87 S88 P89 N96	L70-T91 WeakPolarHBondContact O-CG2 3.29Å; K71-T91 PolarHBondContact O-OG1 3.08Å; K71-T91 VanDerWaalsContact O-OG1 3.07Å; L72-T91 HydrophobicContact CD2-CG2 4.08Å; L87-T91 HydrophobicContact CD1-CG2 3.64Å; S88-T91 PolarHBondContact N-OG1 2.9Å; S88-T91 WeakPolarHBondContact O-CB 2.95Å; S88-T91 PolarHBondContact O-N 3.09Å; S88-T91 PolarHBondContact O-OG1 2.64Å; P89-T91 VanDerWaalsContact C-N 3.31Å; T91-N96 HydrophobicContact CG2-CB 4.29Å
92	D	71.2	Confident	86	Confident	121 Å²	121	55 Å²	55	65%	0.647	28%	0.282	S	S	*	.	S	Bend	trans	-74.3	-33.1	-177.2	-53.3	-59.6	0	0	0	112.3	K71	K71-D92 IonicContact NZ-OD2 2.68Å; K71-D92 PolarHBondContact NZ-OD2 3Å
93	N	80.9	Confident	86.1	Confident	92 Å²	92	53.3 Å²	53.3	49%	0.492	27%	0.273	S	S	.	.			trans	-128.5	128.3	-170.5	-67.8	-34.4	0	0	0	113.8	Q95 N96	N93-Q95 PolarHBondContact O-N 3.32Å; N93-N96 WeakPolarHBondContact O-CB 3.13Å; N93-N96 PolarHBondContact O-N 3.49Å
94	I	84	Confident	86.1	Confident	129 Å²	129	53.4 Å²	53.4	66%	0.662	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.3	174.8	-61	167.9	0	0	0	111.5	N96 L97	I94-N96 PolarHBondContact O-N 2.86Å; I94-L97 WeakPolarHBondContact O-CB 3.39Å; I94-L97 PolarHBondContact O-N 2.67Å; I94-L97 VanDerWaalsContact O-N 3.16Å
95	Q	86.7	Confident	86.1	Confident	137 Å²	137	56.6 Å²	56.6	64%	0.64	29%	0.285	S	S	*	.	H	α-helix	trans	-61.6	-27.1	179	-66.1	-178.6	-12.2	0	0	113	N93 L97 Q98 K99	N93-Q95 PolarHBondContact O-N 3.32Å; Q95-L97 PolarHBondContact O-N 3.48Å; Q95-Q98 WeakPolarHBondContact O-CB 3.36Å; Q95-Q98 PolarHBondContact O-N 3.47Å; Q95-K99 PolarHBondContact O-N 3.07Å; Q95-K99 VanDerWaalsContact O-N 3.1Å
96	N	88.8	Confident	86.2	Confident	21 Å²	21	56.6 Å²	56.6	11%	0.112	29%	0.285	C	S	.	.	H	α-helix	trans	-60.4	-34.2	177.6	-72.8	-2.2	0	0	0	112.1	L70 L72 T91 N93 I94 Q98 K99 A100	L70-N96 HydrophobicContact CB-CB 4.14Å; L70-N96 HydrophobicContact CD2-CB 3.8Å; L70-N96 HydrophobicContact CG-CB 4.46Å; L72-N96 HydrophobicContact CD1-CB 4.4Å; L72-N96 WeakPolarHBondContact CD1-O 3.41Å; T91-N96 HydrophobicContact CG2-CB 4.29Å; N93-N96 WeakPolarHBondContact O-CB 3.13Å; N93-N96 PolarHBondContact O-N 3.49Å; I94-N96 PolarHBondContact O-N 2.86Å; N96-Q98 VanDerWaalsContact C-N 3.27Å; N96-Q98 PolarHBondContact O-N 3.17Å; N96-K99 PolarHBondContact O-N 3.47Å; N96-A100 WeakPolarHBondContact O-CB 2.97Å; N96-A100 PolarHBondContact O-N 3.08Å
97	L	90.4	Very high	86.4	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-38.7	176.3	-179	62	0	0	0	111.5	E40 R43 I85 I94 Q95 A101	E40-L97 WeakPolarHBondContact O-CD2 3.37Å; R43-L97 HydrophobicContact CB-CD1 4.26Å; R43-L97 HydrophobicContact CG-CD1 3.84Å; R43-L97 HydrophobicContact CG-CD2 3.94Å; R43-L97 HydrophobicContact CG-CG 3.67Å; I85-L97 HydrophobicContact CB-CD1 4.07Å; I85-L97 HydrophobicContact CG2-CD1 3.62Å; I94-L97 WeakPolarHBondContact O-CB 3.39Å; I94-L97 PolarHBondContact O-N 2.67Å; I94-L97 VanDerWaalsContact O-N 3.16Å; Q95-L97 PolarHBondContact O-N 3.48Å; L97-A101 WeakPolarHBondContact O-CB 3.4Å; L97-A101 PolarHBondContact O-N 3.49Å
98	Q	90.1	Very high	86.7	Confident	70 Å²	70	51.9 Å²	51.9	33%	0.327	27%	0.266	S	S	.	.	H	α-helix	trans	-69.9	-45.5	176.9	-179	62.6	34.2	0	0	111	Q95 N96 A100 A101 D102	Q95-Q98 WeakPolarHBondContact O-CB 3.36Å; Q95-Q98 PolarHBondContact O-N 3.47Å; N96-Q98 VanDerWaalsContact C-N 3.27Å; N96-Q98 PolarHBondContact O-N 3.17Å; Q98-A100 VanDerWaalsContact C-N 3.35Å; Q98-A100 PolarHBondContact O-N 3.5Å; Q98-A101 CarbonylContact O-C 3.57Å; Q98-A101 WeakPolarHBondContact O-CA 3.14Å; Q98-A101 WeakPolarHBondContact O-CB 3.47Å; Q98-A101 PolarHBondContact O-N 2.87Å; Q98-D102 PolarHBondContact NE2-OD1 2.83Å; Q98-D102 PolarHBondContact NE2-OD2 3.06Å; Q98-D102 PolarHBondContact O-N 3.09Å
99	K	90.4	Very high	87.2	Confident	44 Å²	44	53.8 Å²	53.8	19%	0.191	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-45	176	-62.7	-174.7	-170.7	-167.9	0	112.2	Q95 N96 A101 D102 F103 D123	Q95-K99 PolarHBondContact O-N 3.07Å; Q95-K99 VanDerWaalsContact O-N 3.1Å; N96-K99 PolarHBondContact O-N 3.47Å; K99-A101 VanDerWaalsContact C-N 3.29Å; K99-A101 PolarHBondContact O-N 3.49Å; K99-D102 PolarHBondContact O-N 2.83Å; K99-F103 WeakPolarHBondContact O-CB 3.35Å; K99-F103 PolarHBondContact O-N 3.32Å; K99-D123 VanDerWaalsContact CE-CG 3.49Å; K99-D123 WeakPolarHBondContact CE-OD1 3.46Å; K99-D123 WeakPolarHBondContact CE-OD2 3.12Å; K99-D123 IonicContact NZ-OD1 2.75Å; K99-D123 PolarHBondContact NZ-OD1 3.34Å; K99-D123 IonicContact NZ-OD2 3.71Å; K99-D123 PolarHBondContact NZ-OD2 3.22Å
100	A	91.7	Very high	88	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-38.1	175.3	0	0	0	0	0	111.9	I66 L70 L72 I85 N96 Q98 F103 V104	I66-A100 HydrophobicContact CG1-CB 4.47Å; I66-A100 HydrophobicContact CG2-CB 4.25Å; L70-A100 HydrophobicContact CD1-CB 3.79Å; L72-A100 HydrophobicContact CD1-CB 3.46Å; L72-A100 VanDerWaalsContact CD1-CB 3.46Å; I85-A100 HydrophobicContact CD1-CB 4.06Å; I85-A100 HydrophobicContact CG2-CB 4.33Å; N96-A100 WeakPolarHBondContact O-CB 2.97Å; N96-A100 PolarHBondContact O-N 3.08Å; Q98-A100 VanDerWaalsContact C-N 3.35Å; Q98-A100 PolarHBondContact O-N 3.5Å; A100-F103 PolarHBondContact O-N 2.78Å; A100-V104 WeakPolarHBondContact O-CG2 3.3Å; A100-V104 PolarHBondContact O-N 2.89Å; A100-V104 VanDerWaalsContact O-N 3.08Å
101	A	92.2	Very high	88.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-40.6	176.4	0	0	0	0	0	112.3	R43 I45 L97 Q98 K99 R105	R43-A101 HydrophobicContact CB-CB 4.44Å; R43-A101 HydrophobicContact CG-CB 4.4Å; I45-A101 HydrophobicContact CD1-CB 3.97Å; I45-A101 WeakPolarHBondContact CD1-O 3.25Å; L97-A101 WeakPolarHBondContact O-CB 3.4Å; L97-A101 PolarHBondContact O-N 3.49Å; Q98-A101 CarbonylContact O-C 3.57Å; Q98-A101 WeakPolarHBondContact O-CA 3.14Å; Q98-A101 WeakPolarHBondContact O-CB 3.47Å; Q98-A101 PolarHBondContact O-N 2.87Å; K99-A101 VanDerWaalsContact C-N 3.29Å; K99-A101 PolarHBondContact O-N 3.49Å; A101-R105 VanDerWaalsContact O-CB 3.3Å; A101-R105 WeakPolarHBondContact O-CB 3.42Å; A101-R105 VanDerWaalsContact O-CG 3.25Å; A101-R105 WeakPolarHBondContact O-CG 3.39Å; A101-R105 PolarHBondContact O-N 3.18Å; A101-R105 PolarHBondContact O-NE 3.16Å
102	D	92.7	Very high	89.9	Confident	57 Å²	57	43.8 Å²	43.8	31%	0.305	23%	0.228	S	C	.	.	H	α-helix	trans	-67.2	-39.2	175.9	-70.4	-34.2	0	0	0	112.4	Q98 K99 R105 A106	Q98-D102 PolarHBondContact NE2-OD1 2.83Å; Q98-D102 PolarHBondContact NE2-OD2 3.06Å; Q98-D102 PolarHBondContact O-N 3.09Å; K99-D102 PolarHBondContact O-N 2.83Å; D102-R105 PolarHBondContact O-N 3.08Å; D102-R105 IonicContact OD1-CZ 3.44Å; D102-R105 IonicContact OD1-NE 3.17Å; D102-R105 PolarHBondContact OD1-NE 3.09Å; D102-R105 IonicContact OD1-NH2 3.37Å; D102-R105 PolarHBondContact OD1-NH2 3.49Å; D102-R105 IonicContact OD2-NH2 3.85Å; D102-A106 WeakPolarHBondContact O-CB 3.43Å; D102-A106 PolarHBondContact O-N 2.84Å
103	F	93	Very high	90.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-50.6	173.3	174.4	-118.4	0	0	0	112.4	I62 P65 I66 K99 A100 R105 A106 F107 V113 A116 L117 V120	I62-F103 HydrophobicContact CB-CE1 4.28Å; I62-F103 HydrophobicContact CG2-CE1 3.8Å; P65-F103 HydrophobicContact CG-CE1 4.2Å; P65-F103 HydrophobicContact CG-CZ 4.23Å; I66-F103 HydrophobicContact CD1-CD1 3.82Å; I66-F103 HydrophobicContact CD1-CE1 4.05Å; I66-F103 HydrophobicContact CG1-CD1 3.96Å; I66-F103 HydrophobicContact CG1-CE1 4.16Å; K99-F103 WeakPolarHBondContact O-CB 3.35Å; K99-F103 PolarHBondContact O-N 3.32Å; A100-F103 PolarHBondContact O-N 2.78Å; F103-R105 VanDerWaalsContact C-N 3.35Å; F103-R105 PolarHBondContact O-N 3.42Å; F103-A106 PolarHBondContact O-N 3Å; F103-F107 PolarHBondContact O-N 3.35Å; F103-F107 VanDerWaalsContact O-N 3.09Å; F103-V113 HydrophobicContact CZ-CG1 4.25Å; F103-A116 HydrophobicContact CD2-CB 3.51Å; F103-A116 VanDerWaalsContact CD2-O 3.25Å; F103-A116 WeakPolarHBondContact CD2-O 3.45Å; F103-A116 VanDerWaalsContact CE2-C 3.47Å; F103-A116 HydrophobicContact CE2-CB 3.47Å; F103-A116 VanDerWaalsContact CE2-CB 3.47Å; F103-L117 HydrophobicContact CE2-CB 4.32Å; F103-V120 HydrophobicContact CB-CG2 3.89Å; F103-V120 HydrophobicContact CD1-CG2 4.5Å; F103-V120 HydrophobicContact CD2-CG2 4.03Å; F103-V120 HydrophobicContact CG-CG2 3.9Å
104	V	92.7	Very high	91.5	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-37.6	178.1	175.4	0	0	0	0	110.9	I45 I62 I66 I74 V83 I85 A100 F107 V108	I45-V104 HydrophobicContact CB-CG1 4.24Å; I45-V104 HydrophobicContact CD1-CB 3.63Å; I45-V104 HydrophobicContact CD1-CG1 3.73Å; I45-V104 HydrophobicContact CG2-CG1 4.05Å; I62-V104 HydrophobicContact CG2-CG2 4.47Å; I66-V104 HydrophobicContact CD1-CG2 3.97Å; I74-V104 HydrophobicContact CD1-CG2 4.39Å; V83-V104 HydrophobicContact CB-CG1 4.08Å; V83-V104 HydrophobicContact CG1-CG1 4.06Å; V83-V104 HydrophobicContact CG1-CG2 4.44Å; V83-V104 HydrophobicContact CG2-CG1 4.16Å; I85-V104 HydrophobicContact CD1-CG2 4.11Å; A100-V104 WeakPolarHBondContact O-CG2 3.3Å; A100-V104 PolarHBondContact O-N 2.89Å; A100-V104 VanDerWaalsContact O-N 3.08Å; V104-F107 PolarHBondContact O-N 2.65Å; V104-V108 HydrophobicContact CG1-CG2 4.44Å; V104-V108 WeakPolarHBondContact O-CB 3.48Å; V104-V108 VanDerWaalsContact O-CG2 3.27Å; V104-V108 WeakPolarHBondContact O-CG2 3.33Å; V104-V108 PolarHBondContact O-N 3.11Å
105	R	92.8	Very high	91.9	Very high	88 Å²	88	35.4 Å²	35.4	33%	0.332	18%	0.184	S	C	.	.	H	α-helix	trans	-60.1	-46.4	173.5	-81.6	-172.7	-78.1	-124	-5.7	111.7	I45 A101 D102 F103 F107 V108 L109	I45-R105 HydrophobicContact CD1-CG 4.47Å; I45-R105 HydrophobicContact CG2-CG 4.1Å; A101-R105 VanDerWaalsContact O-CB 3.3Å; A101-R105 WeakPolarHBondContact O-CB 3.42Å; A101-R105 VanDerWaalsContact O-CG 3.25Å; A101-R105 WeakPolarHBondContact O-CG 3.39Å; A101-R105 PolarHBondContact O-N 3.18Å; A101-R105 PolarHBondContact O-NE 3.16Å; D102-R105 PolarHBondContact O-N 3.08Å; D102-R105 IonicContact OD1-CZ 3.44Å; D102-R105 IonicContact OD1-NE 3.17Å; D102-R105 PolarHBondContact OD1-NE 3.09Å; D102-R105 IonicContact OD1-NH2 3.37Å; D102-R105 PolarHBondContact OD1-NH2 3.49Å; D102-R105 IonicContact OD2-NH2 3.85Å; F103-R105 VanDerWaalsContact C-N 3.35Å; F103-R105 PolarHBondContact O-N 3.42Å; R105-F107 VanDerWaalsContact C-N 3.33Å; R105-F107 PolarHBondContact O-N 3.24Å; R105-V108 WeakPolarHBondContact O-CB 3.45Å; R105-V108 PolarHBondContact O-N 3.39Å; R105-V108 VanDerWaalsContact O-N 3.11Å; R105-L109 WeakPolarHBondContact O-CG 3.44Å; R105-L109 PolarHBondContact O-N 2.91Å
106	A	93.6	Very high	92.1	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-43.8	177.7	0	0	0	0	0	111.6	D102 F103 V108 L109 G110 F111 A116 L119 V127	D102-A106 WeakPolarHBondContact O-CB 3.43Å; D102-A106 PolarHBondContact O-N 2.84Å; F103-A106 PolarHBondContact O-N 3Å; A106-V108 VanDerWaalsContact C-N 3.31Å; A106-V108 PolarHBondContact O-N 3.36Å; A106-L109 PolarHBondContact O-N 3.39Å; A106-G110 PolarHBondContact O-N 2.86Å; A106-F111 HydrophobicContact CB-CD2 4.1Å; A106-F111 WeakPolarHBondContact O-CB 3.26Å; A106-F111 WeakPolarHBondContact O-CD2 3.32Å; A106-F111 PolarHBondContact O-N 3.34Å; A106-A116 HydrophobicContact CB-CB 4.16Å; A106-L119 HydrophobicContact CB-CD1 3.39Å; A106-V127 HydrophobicContact CB-CG2 4.14Å
107	F	93	Very high	92.2	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-39.4	174.6	-178	-97.1	0	0	0	112.3	R51 P54 L55 I62 F103 V104 R105 L109 G110 V113	R51-F107 VanDerWaalsContact CZ-O 3.31Å; R51-F107 PolarHBondContact NE-O 3.08Å; R51-F107 VanDerWaalsContact NE-O 3.13Å; R51-F107 PolarHBondContact NH2-O 2.91Å; P54-F107 HydrophobicContact CB-CZ 3.94Å; L55-F107 HydrophobicContact CB-CE1 3.89Å; L55-F107 HydrophobicContact CD1-CD1 3.85Å; L55-F107 HydrophobicContact CD1-CE1 3.61Å; L55-F107 HydrophobicContact CG-CE1 4.39Å; I62-F107 HydrophobicContact CD1-CD1 3.84Å; I62-F107 HydrophobicContact CD1-CD2 4.04Å; I62-F107 HydrophobicContact CD1-CE1 3.79Å; I62-F107 HydrophobicContact CD1-CE2 3.98Å; I62-F107 HydrophobicContact CD1-CG 3.96Å; I62-F107 HydrophobicContact CD1-CZ 3.85Å; F103-F107 PolarHBondContact O-N 3.35Å; F103-F107 VanDerWaalsContact O-N 3.09Å; V104-F107 PolarHBondContact O-N 2.65Å; R105-F107 VanDerWaalsContact C-N 3.33Å; R105-F107 PolarHBondContact O-N 3.24Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 2.9Å; F107-G110 PolarHBondContact O-N 3.44Å; F107-V113 HydrophobicContact CD2-CG2 3.8Å; F107-V113 HydrophobicContact CE2-CG2 3.58Å
108	V	92.9	Very high	92.3	Very high	17 Å²	17	31 Å²	31	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-37.8	176.5	163.8	0	0	0	0	112	I45 V47 P48 V104 R105 A106 G110	I45-V108 HydrophobicContact CG2-CG2 4.37Å; V47-V108 HydrophobicContact CB-CG2 4.43Å; V47-V108 HydrophobicContact CG1-CG2 4.32Å; V47-V108 HydrophobicContact CG2-CG2 3.86Å; P48-V108 HydrophobicContact CG-CG1 4.03Å; V104-V108 HydrophobicContact CG1-CG2 4.44Å; V104-V108 WeakPolarHBondContact O-CB 3.48Å; V104-V108 VanDerWaalsContact O-CG2 3.27Å; V104-V108 WeakPolarHBondContact O-CG2 3.33Å; V104-V108 PolarHBondContact O-N 3.11Å; R105-V108 WeakPolarHBondContact O-CB 3.45Å; R105-V108 PolarHBondContact O-N 3.39Å; R105-V108 VanDerWaalsContact O-N 3.11Å; A106-V108 VanDerWaalsContact C-N 3.31Å; A106-V108 PolarHBondContact O-N 3.36Å; V108-G110 PolarHBondContact O-N 3.46Å
109	L	91.7	Very high	92.3	Very high	53 Å²	53	28.2 Å²	28.2	28%	0.277	16%	0.157	S	C	.	.	H	α-helix	trans	-70.7	-11.1	177	-65.9	175.2	0	0	0	113.8	R105 A106 F107 F111 V127 H177	R105-L109 WeakPolarHBondContact O-CG 3.44Å; R105-L109 PolarHBondContact O-N 2.91Å; A106-L109 PolarHBondContact O-N 3.39Å; F107-L109 VanDerWaalsContact C-N 3.32Å; F107-L109 PolarHBondContact O-N 2.9Å; L109-F111 HydrophobicContact CB-CD2 4.41Å; L109-V127 HydrophobicContact CD1-CG1 3.66Å; L109-H177 PolarHBondContact O-CD2 2.7Å
110	G	92.3	Very high	92.2	Very high	26 Å²	26	27 Å²	27	27%	0.268	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	110.2	5.2	173.6	0	0	0	0	0	115.3	A106 F107 V108	A106-G110 PolarHBondContact O-N 2.86Å; F107-G110 PolarHBondContact O-N 3.44Å; V108-G110 PolarHBondContact O-N 3.46Å
111	F	94	Very high	92.1	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.018	19%	0.188	C	C	.	.			trans	-64.9	153.5	172.6	-70.3	-76.5	0	0	0	111.5	A106 L109 V127 R168 V170 H177 L179	A106-F111 HydrophobicContact CB-CD2 4.1Å; A106-F111 WeakPolarHBondContact O-CB 3.26Å; A106-F111 WeakPolarHBondContact O-CD2 3.32Å; A106-F111 PolarHBondContact O-N 3.34Å; L109-F111 HydrophobicContact CB-CD2 4.41Å; F111-V127 HydrophobicContact CE2-CG1 3.88Å; F111-R168 HydrophobicContact CD1-CB 3.96Å; F111-R168 HydrophobicContact CE1-CB 3.74Å; F111-R168 WeakPolarHBondContact CE1-O 3.32Å; F111-V170 HydrophobicContact CD1-CG2 3.6Å; F111-V170 HydrophobicContact CD2-CG2 4.37Å; F111-V170 HydrophobicContact CE1-CG2 3.65Å; F111-V170 HydrophobicContact CE2-CG2 4.42Å; F111-V170 HydrophobicContact CG-CG2 3.97Å; F111-V170 HydrophobicContact CZ-CG2 4.07Å; F111-H177 HydrophobicContact CE2-CB 3.76Å; F111-H177 HydrophobicContact CZ-CB 3.85Å; F111-L179 HydrophobicContact CD1-CB 4.13Å; F111-L179 HydrophobicContact CD1-CD1 4.13Å; F111-L179 HydrophobicContact CD2-CD1 4.33Å; F111-L179 HydrophobicContact CE1-CB 3.51Å; F111-L179 HydrophobicContact CE1-CD1 4.34Å; F111-L179 HydrophobicContact CE2-CB 4.09Å; F111-L179 HydrophobicContact CG-CD1 4.14Å; F111-L179 HydrophobicContact CZ-CB 3.49Å; F111-L179 VanDerWaalsContact CZ-CB 3.49Å
112	S	92.8	Very high	91.8	Very high	48 Å²	48	41.1 Å²	41.1	34%	0.336	21%	0.214	S	C	.	.			trans	-66.6	157	171.5	77.9	0	0	0	0	110.1	D114 D115 A116	S112-D114 VanDerWaalsContact C-N 3.28Å; S112-D114 PolarHBondContact O-N 2.98Å; S112-D115 PolarHBondContact O-N 3.09Å; S112-D115 VanDerWaalsContact OG-CB 3.32Å; S112-D115 WeakPolarHBondContact OG-CB 3.27Å; S112-D115 PolarHBondContact OG-N 3.14Å; S112-D115 VanDerWaalsContact OG-N 3.11Å; S112-D115 PolarHBondContact OG-OD2 3.41Å; S112-A116 WeakPolarHBondContact O-CB 3.25Å; S112-A116 PolarHBondContact O-N 3.16Å
113	V	92.7	Very high	91.5	Very high	11 Å²	11	42.8 Å²	42.8	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-37.9	179.2	-175.3	0	0	0	0	110.7	N58 K61 I62 F103 F107 A116 L117	N58-V113 HydrophobicContact CB-CG2 3.84Å; K61-V113 HydrophobicContact CB-CG1 3.84Å; I62-V113 HydrophobicContact CG1-CG1 4.25Å; I62-V113 HydrophobicContact CG1-CG2 4.36Å; F103-V113 HydrophobicContact CZ-CG1 4.25Å; F107-V113 HydrophobicContact CD2-CG2 3.8Å; F107-V113 HydrophobicContact CE2-CG2 3.58Å; V113-A116 PolarHBondContact O-N 3.06Å; V113-L117 WeakPolarHBondContact O-CB 3.29Å; V113-L117 PolarHBondContact O-N 3.36Å
114	D	92.6	Very high	91.4	Very high	118 Å²	118	49.7 Å²	49.7	63%	0.631	26%	0.255	S	S	*	.	H	α-helix	trans	-66.5	-41.4	-179.5	-55.7	-58.2	0	0	0	111.5	S112 L117	S112-D114 VanDerWaalsContact C-N 3.28Å; S112-D114 PolarHBondContact O-N 2.98Å; D114-L117 PolarHBondContact O-N 2.89Å
115	D	92	Very high	91.3	Very high	36 Å²	36	51 Å²	51	19%	0.193	26%	0.262	C	S	.	.	H	α-helix	trans	-68.5	-39.7	174.9	-64.4	-41.6	0	0	0	111.6	S112 L117 A118 R168	S112-D115 PolarHBondContact O-N 3.09Å; S112-D115 VanDerWaalsContact OG-CB 3.32Å; S112-D115 WeakPolarHBondContact OG-CB 3.27Å; S112-D115 PolarHBondContact OG-N 3.14Å; S112-D115 VanDerWaalsContact OG-N 3.11Å; S112-D115 PolarHBondContact OG-OD2 3.41Å; D115-L117 VanDerWaalsContact C-N 3.28Å; D115-L117 PolarHBondContact O-N 3.39Å; D115-A118 VanDerWaalsContact O-CB 3.26Å; D115-A118 WeakPolarHBondContact O-CB 3.34Å; D115-A118 PolarHBondContact O-N 3.33Å; D115-R168 HydrophobicContact CB-CG 4.05Å; D115-R168 IonicContact OD1-CZ 3.54Å; D115-R168 IonicContact OD1-NE 3.92Å; D115-R168 PolarHBondContact OD1-NE 3.2Å; D115-R168 IonicContact OD1-NH2 3.55Å; D115-R168 IonicContact OD2-NE 2.74Å
116	A	91.6	Very high	91.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-34.9	177	0	0	0	0	0	111.1	F103 A106 S112 V113 A118 L119	F103-A116 HydrophobicContact CD2-CB 3.51Å; F103-A116 VanDerWaalsContact CD2-O 3.25Å; F103-A116 WeakPolarHBondContact CD2-O 3.45Å; F103-A116 VanDerWaalsContact CE2-C 3.47Å; F103-A116 HydrophobicContact CE2-CB 3.47Å; F103-A116 VanDerWaalsContact CE2-CB 3.47Å; A106-A116 HydrophobicContact CB-CB 4.16Å; S112-A116 WeakPolarHBondContact O-CB 3.25Å; S112-A116 PolarHBondContact O-N 3.16Å; V113-A116 PolarHBondContact O-N 3.06Å; A116-A118 PolarHBondContact O-N 3.22Å; A116-A118 VanDerWaalsContact O-N 3.16Å; A116-L119 VanDerWaalsContact O-CB 3.26Å; A116-L119 WeakPolarHBondContact O-CB 3.46Å; A116-L119 PolarHBondContact O-N 2.68Å
117	L	92.1	Very high	91.3	Very high	37 Å²	37	54.5 Å²	54.5	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-25.8	179.2	-169.8	146.9	0	0	0	111.8	P65 F103 V113 D114 D115 L119 V120 R121	P65-L117 HydrophobicContact CB-CD1 4.44Å; P65-L117 HydrophobicContact CG-CD1 4.43Å; F103-L117 HydrophobicContact CE2-CB 4.32Å; V113-L117 WeakPolarHBondContact O-CB 3.29Å; V113-L117 PolarHBondContact O-N 3.36Å; D114-L117 PolarHBondContact O-N 2.89Å; D115-L117 VanDerWaalsContact C-N 3.28Å; D115-L117 PolarHBondContact O-N 3.39Å; L117-L119 PolarHBondContact O-N 3.37Å; L117-V120 PolarHBondContact O-N 2.84Å; L117-V120 VanDerWaalsContact O-N 3.1Å; L117-R121 HydrophobicContact CD2-CG 4.12Å; L117-R121 PolarHBondContact O-N 3.24Å
118	A	91.1	Very high	91.3	Very high	33 Å²	33	56.7 Å²	56.7	27%	0.273	29%	0.294	S	S	.	.	H	α-helix	trans	-60.1	-32	172.4	0	0	0	0	0	113	D115 A116 V120 R121 L122 L125	D115-A118 VanDerWaalsContact O-CB 3.26Å; D115-A118 WeakPolarHBondContact O-CB 3.34Å; D115-A118 PolarHBondContact O-N 3.33Å; A116-A118 PolarHBondContact O-N 3.22Å; A116-A118 VanDerWaalsContact O-N 3.16Å; A118-V120 VanDerWaalsContact C-N 3.27Å; A118-V120 PolarHBondContact O-N 2.6Å; A118-R121 PolarHBondContact O-N 2.74Å; A118-L122 PolarHBondContact O-N 2.86Å; A118-L125 HydrophobicContact CB-CD2 3.77Å
119	L	90	Very high	91.3	Very high	12 Å²	12	59.2 Å²	59.2	6%	0.063	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-27.8	175.8	-65.7	163.8	0	0	0	112.8	A106 A116 L117 L125 V127 L179	A106-L119 HydrophobicContact CB-CD1 3.39Å; A116-L119 VanDerWaalsContact O-CB 3.26Å; A116-L119 WeakPolarHBondContact O-CB 3.46Å; A116-L119 PolarHBondContact O-N 2.68Å; L117-L119 PolarHBondContact O-N 3.37Å; L119-L125 HydrophobicContact CD2-CB 3.95Å; L119-L125 HydrophobicContact CD2-CD2 4.09Å; L119-L125 HydrophobicContact CD2-CG 4.2Å; L119-L125 VanDerWaalsContact CD2-O 3.27Å; L119-L125 WeakPolarHBondContact CD2-O 3.15Å; L119-L125 HydrophobicContact CG-CD2 4.38Å; L119-V127 HydrophobicContact CD1-CG2 3.87Å; L119-V127 HydrophobicContact CD2-CG2 4.09Å; L119-L179 HydrophobicContact CD1-CD1 3.89Å; L119-L179 HydrophobicContact CD2-CD1 4.35Å; L119-L179 HydrophobicContact CD2-CG 4.45Å; L119-L179 HydrophobicContact CG-CD1 4.07Å
120	V	89.7	Confident	91.4	Very high	19 Å²	19	57.7 Å²	57.7	12%	0.115	30%	0.303	C	S	.	.	H	α-helix	trans	-77.2	-30.2	176.5	-179.5	0	0	0	0	110.6	L70 F103 L117 A118	L70-V120 HydrophobicContact CD1-CG1 4.2Å; L70-V120 HydrophobicContact CD2-CG1 4.29Å; L70-V120 HydrophobicContact CG-CG1 4.32Å; F103-V120 HydrophobicContact CB-CG2 3.89Å; F103-V120 HydrophobicContact CD1-CG2 4.5Å; F103-V120 HydrophobicContact CD2-CG2 4.03Å; F103-V120 HydrophobicContact CG-CG2 3.9Å; L117-V120 PolarHBondContact O-N 2.84Å; L117-V120 VanDerWaalsContact O-N 3.1Å; A118-V120 VanDerWaalsContact C-N 3.27Å; A118-V120 PolarHBondContact O-N 2.6Å
121	R	88.8	Confident	91.4	Very high	192 Å²	192	59.4 Å²	59.4	73%	0.725	31%	0.305	S	S	*	.	H	α-helix	trans	-83.6	-44.3	-177.2	-67.5	-177.9	175.7	163.6	3.6	113.2	L117 A118	L117-R121 HydrophobicContact CD2-CG 4.12Å; L117-R121 PolarHBondContact O-N 3.24Å; A118-R121 PolarHBondContact O-N 2.74Å
122	L	86.7	Confident	91.3	Very high	105 Å²	105	59.2 Å²	59.2	55%	0.55	30%	0.304	S	S	.	.			trans	-118	124.5	-176	-83.7	73.7	0	0	0	110.5	A118 E124	A118-L122 PolarHBondContact O-N 2.86Å; L122-E124 VanDerWaalsContact C-N 3.32Å; L122-E124 PolarHBondContact O-N 2.91Å
123	D	86.1	Confident	91.2	Very high	93 Å²	93	60.7 Å²	60.7	50%	0.497	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.5	-176.7	-65.5	-12.3	0	0	0	113.5	K99 L125	K99-D123 VanDerWaalsContact CE-CG 3.49Å; K99-D123 WeakPolarHBondContact CE-OD1 3.46Å; K99-D123 WeakPolarHBondContact CE-OD2 3.12Å; K99-D123 IonicContact NZ-OD1 2.75Å; K99-D123 PolarHBondContact NZ-OD1 3.34Å; K99-D123 IonicContact NZ-OD2 3.71Å; K99-D123 PolarHBondContact NZ-OD2 3.22Å; D123-L125 VanDerWaalsContact C-N 3.26Å; D123-L125 PolarHBondContact O-N 3.48Å
124	E	89.5	Confident	91.2	Very high	144 Å²	144	65.9 Å²	65.9	67%	0.673	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	3.7	179.9	-58.8	-173.5	165.3	0	0	113.5	L122 F126	L122-E124 VanDerWaalsContact C-N 3.32Å; L122-E124 PolarHBondContact O-N 2.91Å; E124-F126 WeakPolarHBondContact O-CD2 3.39Å; E124-F126 WeakPolarHBondContact O-CE2 3.5Å
125	L	92.4	Very high	91	Very high	31 Å²	31	62.4 Å²	62.4	16%	0.162	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.6	-177.5	-149.6	76.8	0	0	0	109.3	A118 L119 D123 L179 G180	A118-L125 HydrophobicContact CB-CD2 3.77Å; L119-L125 HydrophobicContact CD2-CB 3.95Å; L119-L125 HydrophobicContact CD2-CD2 4.09Å; L119-L125 HydrophobicContact CD2-CG 4.2Å; L119-L125 VanDerWaalsContact CD2-O 3.27Å; L119-L125 WeakPolarHBondContact CD2-O 3.15Å; L119-L125 HydrophobicContact CG-CD2 4.38Å; D123-L125 VanDerWaalsContact C-N 3.26Å; D123-L125 PolarHBondContact O-N 3.48Å; L125-L179 HydrophobicContact CD2-CD2 3.43Å; L125-L179 VanDerWaalsContact CD2-CD2 3.43Å; L125-L179 HydrophobicContact CD2-CG 4.19Å; L125-L179 HydrophobicContact CG-CD2 3.95Å; L125-L179 HydrophobicContact CG-CG 4.48Å; L125-G180 VanDerWaalsContact CD1-C 3.45Å
126	F	92.4	Very high	90.8	Very high	110 Å²	110	65 Å²	65	48%	0.482	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	156.5	-176.8	-60.4	-78.8	0	0	0	110.6	E124 L179 G180 I185	E124-F126 WeakPolarHBondContact O-CD2 3.39Å; E124-F126 WeakPolarHBondContact O-CE2 3.5Å; F126-L179 WeakPolarHBondContact O-CA 3.36Å; F126-G180 PolarHBondContact N-O 3.44Å; F126-G180 PolarHBondContact O-N 3.27Å; F126-I185 HydrophobicContact CB-CD1 3.98Å; F126-I185 WeakPolarHBondContact O-CD1 2.91Å
127	V	92.8	Very high	90.6	Very high	51 Å²	51	70.6 Å²	70.6	31%	0.309	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.5	170.4	-178.4	0	0	0	0	108.5	A106 L109 F111 L119 I178 L179	A106-V127 HydrophobicContact CB-CG2 4.14Å; L109-V127 HydrophobicContact CD1-CG1 3.66Å; F111-V127 HydrophobicContact CE2-CG1 3.88Å; L119-V127 HydrophobicContact CD1-CG2 3.87Å; L119-V127 HydrophobicContact CD2-CG2 4.09Å; V127-I178 WeakPolarHBondContact CA-O 3.29Å; V127-L179 HydrophobicContact CG2-CB 4.39Å; V127-L179 HydrophobicContact CG2-CD1 4.12Å; V127-L179 HydrophobicContact CG2-CG 4.26Å
128	E	93.4	Very high	90.4	Very high	51 Å²	51	69.7 Å²	69.7	24%	0.238	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.8	176.6	-169.5	171	145	0	0	110.9	H177 I178 I185 R189	E128-H177 CarbonylContact O-C 3.6Å; E128-H177 VanDerWaalsContact O-CA 3.27Å; E128-H177 WeakPolarHBondContact O-CA 3.38Å; E128-I178 PolarHBondContact N-O 3.48Å; E128-I178 PolarHBondContact O-N 3.07Å; E128-I185 HydrophobicContact CB-CG2 4Å; E128-I185 WeakPolarHBondContact OE2-CG2 3.27Å; E128-R189 IonicContact OE1-CZ 3.84Å; E128-R189 IonicContact OE1-NE 2.6Å; E128-R189 PolarHBondContact OE1-NE 3.05Å; E128-R189 IonicContact OE1-NH2 3.63Å; E128-R189 PolarHBondContact OE1-NH2 3.03Å; E128-R189 IonicContact OE2-CZ 2.64Å; E128-R189 IonicContact OE2-NE 3.04Å; E128-R189 IonicContact OE2-NH2 3Å; E128-R189 PolarHBondContact OE2-NH2 2.69Å
129	S	93.2	Very high	90.3	Very high	70 Å²	70	76.8 Å²	76.8	49%	0.49	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.4	174.9	-57.1	0	0	0	0	108.9	H177	S129-H177 WeakPolarHBondContact CB-ND1 3.32Å; S129-H177 PolarHBondContact OG-CE1 3.35Å; S129-H177 PolarHBondContact OG-ND1 3.07Å
130	F	92.8	Very high	90.2	Very high	20 Å²	20	79 Å²	79	9%	0.088	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.1	-176.4	173	-100.8	0	0	0	109.4	D134 V135 I176 I196	F130-D134 HydrophobicContact CE2-CB 3.9Å; F130-D134 HydrophobicContact CZ-CB 4.34Å; F130-V135 HydrophobicContact CE1-CG2 4.15Å; F130-V135 HydrophobicContact CE2-CG2 3.75Å; F130-V135 HydrophobicContact CZ-CB 3.85Å; F130-V135 HydrophobicContact CZ-CG2 3.18Å; F130-I176 HydrophobicContact CD1-CD1 4.35Å; F130-I176 PolarHBondContact N-O 3.28Å; F130-I176 PolarHBondContact O-N 3.39Å; F130-I196 HydrophobicContact CE1-CD1 3.8Å
131	E	93	Very high	90.4	Very high	63 Å²	63	84.2 Å²	84.2	29%	0.294	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	137.1	175.5	-56.4	-161.2	173.5	0	0	111.1	H133 D134 S174 K175	E131-H133 PolarHBondContact O-N 2.79Å; E131-H133 VanDerWaalsContact O-N 3.14Å; E131-D134 WeakPolarHBondContact O-CB 3.42Å; E131-D134 PolarHBondContact O-N 2.83Å; E131-S174 WeakPolarHBondContact CA-O 3.47Å; E131-K175 HydrophobicContact CG-CG 4.21Å; E131-K175 WeakPolarHBondContact OE1-CE 3.42Å; E131-K175 IonicContact OE1-NZ 2.66Å; E131-K175 PolarHBondContact OE1-NZ 3.05Å
132	V	92.2	Very high	90.6	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-58.9	-30.9	178.5	177.8	0	0	0	0	111.6	D134 V135 K136 L138 L143 S174 I176 I196	V132-D134 PolarHBondContact O-N 3.34Å; V132-V135 PolarHBondContact O-N 2.94Å; V132-K136 PolarHBondContact O-N 3.11Å; V132-L138 HydrophobicContact CG1-CD1 4.36Å; V132-L143 HydrophobicContact CB-CD1 4Å; V132-L143 HydrophobicContact CG1-CD1 3.73Å; V132-S174 WeakPolarHBondContact CG2-O 3.29Å; V132-S174 PolarHBondContact N-O 3.5Å; V132-I176 HydrophobicContact CG2-CD1 3.8Å; V132-I176 HydrophobicContact CG2-CG1 4.31Å; V132-I196 HydrophobicContact CB-CD1 4.47Å; V132-I196 HydrophobicContact CG1-CD1 4.15Å; V132-I196 HydrophobicContact CG1-CG1 4.3Å; V132-I196 HydrophobicContact CG1-CG2 3.93Å; V132-I196 HydrophobicContact CG2-CD1 4.14Å
133	H	91.2	Very high	90.8	Very high	78 Å²	78	76.9 Å²	76.9	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-62.8	-28.5	177.9	-65.2	-63.7	0	0	0	113.4	E131 V135 K136 L138	E131-H133 PolarHBondContact O-N 2.79Å; E131-H133 VanDerWaalsContact O-N 3.14Å; H133-V135 VanDerWaalsContact C-N 3.32Å; H133-V135 PolarHBondContact O-N 3.42Å; H133-K136 CarbonylContact O-C 3.56Å; H133-L138 PolarHBondContact CE1-O 2.83Å
134	D	90.8	Very high	91.1	Very high	120 Å²	120	76.4 Å²	76.4	64%	0.642	41%	0.41	S	S	*	.	H	α-helix	trans	-70.2	-27.8	-178.2	-63.8	-24.2	0	0	0	112.5	F130 E131 V132	F130-D134 HydrophobicContact CE2-CB 3.9Å; F130-D134 HydrophobicContact CZ-CB 4.34Å; E131-D134 WeakPolarHBondContact O-CB 3.42Å; E131-D134 PolarHBondContact O-N 2.83Å; V132-D134 PolarHBondContact O-N 3.34Å
135	V	88.4	Confident	91.3	Very high	45 Å²	45	75.5 Å²	75.5	27%	0.273	40%	0.4	S	S	.	.	H	α-helix	trans	-88.5	-41.7	176.1	161.5	0	0	0	0	111.7	F130 V132 H133 C193 I196 L197	F130-V135 HydrophobicContact CE1-CG2 4.15Å; F130-V135 HydrophobicContact CE2-CG2 3.75Å; F130-V135 HydrophobicContact CZ-CB 3.85Å; F130-V135 HydrophobicContact CZ-CG2 3.18Å; V132-V135 PolarHBondContact O-N 2.94Å; H133-V135 VanDerWaalsContact C-N 3.32Å; H133-V135 PolarHBondContact O-N 3.42Å; V135-C193 HydrophobicContact CG2-CB 4.14Å; V135-C193 VanDerWaalsContact CG2-SG 3.56Å; V135-I196 HydrophobicContact CB-CG2 4.36Å; V135-I196 HydrophobicContact CG1-CB 4.27Å; V135-I196 HydrophobicContact CG1-CG2 3.84Å; V135-L197 HydrophobicContact CG1-CD2 3.93Å; V135-L197 HydrophobicContact CG1-CG 4.01Å
136	K	88.2	Confident	91.3	Very high	90 Å²	90	74.3 Å²	74.3	39%	0.391	40%	0.395	S	S	.	.			trans	-151.2	125.2	-179.5	-169.5	169.7	177.1	174.4	0	109.7	V132 H133 L138 I196	V132-K136 PolarHBondContact O-N 3.11Å; H133-K136 CarbonylContact O-C 3.56Å; K136-L138 VanDerWaalsContact C-N 3.32Å; K136-L138 HydrophobicContact CB-CD2 4.41Å; K136-L138 HydrophobicContact CB-CG 4.11Å; K136-L138 HydrophobicContact CD-CD2 3.66Å; K136-L138 HydrophobicContact CD-CG 4.22Å; K136-L138 HydrophobicContact CG-CD2 3.69Å; K136-L138 HydrophobicContact CG-CG 3.93Å; K136-L138 PolarHBondContact O-N 2.89Å; K136-I196 HydrophobicContact CB-CG2 4.34Å
137	P	88.5	Confident	91.3	Very high	118 Å²	118	70.8 Å²	70.8	77%	0.766	38%	0.381	S	S	*	.			trans	-70.1	91.3	174.4	28.6	-33.7	0	0	0	109.5
138	L	86.4	Confident	91.3	Very high	18 Å²	18	70.5 Å²	70.5	9%	0.094	39%	0.387	C	S	.	.			trans	-100.9	144	177.5	-62.5	178.3	0	0	0	110.4	V132 H133 K136 H142 L143 A146 I196	V132-L138 HydrophobicContact CG1-CD1 4.36Å; H133-L138 PolarHBondContact CE1-O 2.83Å; K136-L138 VanDerWaalsContact C-N 3.32Å; K136-L138 HydrophobicContact CB-CD2 4.41Å; K136-L138 HydrophobicContact CB-CG 4.11Å; K136-L138 HydrophobicContact CD-CD2 3.66Å; K136-L138 HydrophobicContact CD-CG 4.22Å; K136-L138 HydrophobicContact CG-CD2 3.69Å; K136-L138 HydrophobicContact CG-CG 3.93Å; K136-L138 PolarHBondContact O-N 2.89Å; L138-H142 HydrophobicContact CB-CB 4.38Å; L138-H142 HydrophobicContact CD2-CB 4.06Å; L138-L143 HydrophobicContact CB-CB 4.31Å; L138-A146 HydrophobicContact CD1-CB 3.77Å; L138-I196 HydrophobicContact CD1-CG2 4.34Å
139	K	89.1	Confident	91.3	Very high	183 Å²	183	73 Å²	73	80%	0.796	40%	0.395	S	S	*	.			trans	-127.9	147.7	176.7	-64.9	-175.6	179.1	-179.2	0	110.6	D141 H142	K139-D141 PolarHBondContact O-N 2.96Å; K139-H142 PolarHBondContact O-N 3.4Å
140	G	89.8	Confident	91.3	Very high	58 Å²	58	69.8 Å²	69.8	60%	0.598	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	-127.4	172.9	0	0	0	0	0	113.8	H142 L143 S144	G140-H142 PolarHBondContact O-N 2.83Å; G140-H142 VanDerWaalsContact O-N 3.13Å; G140-L143 WeakPolarHBondContact O-CB 3.27Å; G140-L143 PolarHBondContact O-N 3.13Å; G140-S144 PolarHBondContact O-N 3.23Å
141	D	93	Very high	91.3	Very high	128 Å²	128	70.2 Å²	70.2	68%	0.684	38%	0.38	S	S	*	.	H	α-helix	trans	-57.2	-30.4	-175.6	-61	-18.3	0	0	0	114	K139 L143 R145	K139-D141 PolarHBondContact O-N 2.96Å; D141-L143 VanDerWaalsContact C-N 3.34Å; D141-R145 VanDerWaalsContact O-CB 3.27Å; D141-R145 WeakPolarHBondContact O-CB 3.48Å; D141-R145 PolarHBondContact O-N 2.99Å
142	H	92.2	Very high	91.3	Very high	111 Å²	111	68.3 Å²	68.3	51%	0.514	38%	0.376	S	S	.	.	H	α-helix	trans	-69.3	-34.5	178.2	-64.7	-79.8	0	0	0	112.1	L138 K139 G140 R145 A146	L138-H142 HydrophobicContact CB-CB 4.38Å; L138-H142 HydrophobicContact CD2-CB 4.06Å; K139-H142 PolarHBondContact O-N 3.4Å; G140-H142 PolarHBondContact O-N 2.83Å; G140-H142 VanDerWaalsContact O-N 3.13Å; H142-R145 PolarHBondContact ND1-NH1 3.23Å; H142-A146 WeakPolarHBondContact O-CB 3.36Å; H142-A146 PolarHBondContact O-N 3.5Å
143	L	92.5	Very high	91.3	Very high	32 Å²	32	76.6 Å²	76.6	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-67.9	-49.1	175.1	178.6	65.3	0	0	0	110	V132 L138 G140 D141 R145 A146 I147	V132-L143 HydrophobicContact CB-CD1 4Å; V132-L143 HydrophobicContact CG1-CD1 3.73Å; L138-L143 HydrophobicContact CB-CB 4.31Å; G140-L143 WeakPolarHBondContact O-CB 3.27Å; G140-L143 PolarHBondContact O-N 3.13Å; D141-L143 VanDerWaalsContact C-N 3.34Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.15Å; L143-A146 WeakPolarHBondContact O-CB 3.34Å; L143-A146 PolarHBondContact O-N 3.26Å; L143-A146 VanDerWaalsContact O-N 3.08Å; L143-I147 HydrophobicContact CD1-CD1 4.17Å; L143-I147 HydrophobicContact CD1-CG1 4.46Å; L143-I147 HydrophobicContact CG-CD1 3.88Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 2.81Å
144	S	92	Very high	91.3	Very high	83 Å²	83	80.2 Å²	80.2	58%	0.58	44%	0.435	S	S	*	.	H	α-helix	trans	-57.3	-42.8	176.4	-179.8	0	0	0	0	111.9	G140 A146 I147 G148	G140-S144 PolarHBondContact O-N 3.23Å; S144-A146 PolarHBondContact O-N 2.83Å; S144-I147 PolarHBondContact O-N 2.75Å; S144-G148 PolarHBondContact O-N 3.18Å
145	R	92.6	Very high	91.4	Very high	126 Å²	126	75.6 Å²	75.6	48%	0.475	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-38.7	175.4	-168.6	-178.1	-60.5	123.3	5	112.8	D141 H142 L143 G148 R149	D141-R145 VanDerWaalsContact O-CB 3.27Å; D141-R145 WeakPolarHBondContact O-CB 3.48Å; D141-R145 PolarHBondContact O-N 2.99Å; H142-R145 PolarHBondContact ND1-NH1 3.23Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.15Å; R145-G148 PolarHBondContact O-N 3.37Å; R145-R149 WeakPolarHBondContact O-CG 3.5Å; R145-R149 PolarHBondContact O-N 3.41Å
146	A	92.8	Very high	91.6	Very high	5 Å²	5	82.3 Å²	82.3	4%	0.041	44%	0.436	C	S	.	.	H	α-helix	trans	-66.5	-44.3	176.4	0	0	0	0	0	111.4	L138 H142 L143 S144 G148 R149 I150	L138-A146 HydrophobicContact CD1-CB 3.77Å; H142-A146 WeakPolarHBondContact O-CB 3.36Å; H142-A146 PolarHBondContact O-N 3.5Å; L143-A146 WeakPolarHBondContact O-CB 3.34Å; L143-A146 PolarHBondContact O-N 3.26Å; L143-A146 VanDerWaalsContact O-N 3.08Å; S144-A146 PolarHBondContact O-N 2.83Å; A146-G148 VanDerWaalsContact C-N 3.33Å; A146-G148 PolarHBondContact O-N 3.37Å; A146-R149 WeakPolarHBondContact O-CB 3.37Å; A146-R149 PolarHBondContact O-N 2.75Å; A146-R149 VanDerWaalsContact O-N 3.13Å; A146-I150 WeakPolarHBondContact O-CG1 3.24Å; A146-I150 PolarHBondContact O-N 2.85Å; A146-I150 VanDerWaalsContact O-N 3.07Å
147	I	93.2	Very high	91.7	Very high	37 Å²	37	78.4 Å²	78.4	19%	0.19	42%	0.419	C	S	.	.	H	α-helix	trans	-60	-44.6	174.4	-64.1	163.5	0	0	0	110.3	L143 S144 R149 I150 A151 V171 D173	L143-I147 HydrophobicContact CD1-CD1 4.17Å; L143-I147 HydrophobicContact CD1-CG1 4.46Å; L143-I147 HydrophobicContact CG-CD1 3.88Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 2.81Å; S144-I147 PolarHBondContact O-N 2.75Å; I147-R149 VanDerWaalsContact C-N 3.27Å; I147-R149 PolarHBondContact O-N 2.93Å; I147-I150 PolarHBondContact O-N 3.13Å; I147-I150 VanDerWaalsContact O-N 3.09Å; I147-A151 PolarHBondContact O-N 3.2Å; I147-V171 HydrophobicContact CG2-CG1 4.09Å; I147-D173 WeakPolarHBondContact CD1-O 3.31Å; I147-D173 WeakPolarHBondContact CG1-O 3.09Å
148	G	93.2	Very high	92	Very high	44 Å²	44	75.6 Å²	75.6	45%	0.454	40%	0.395	S	S	.	.	H	α-helix	trans	-60.6	-32.1	175.4	0	0	0	0	0	113.8	S144 R145 A146 G152	S144-G148 PolarHBondContact O-N 3.18Å; R145-G148 PolarHBondContact O-N 3.37Å; A146-G148 VanDerWaalsContact C-N 3.33Å; A146-G148 PolarHBondContact O-N 3.37Å; G148-G152 WeakPolarHBondContact O-CA 3.37Å; G148-G152 PolarHBondContact O-N 3.32Å
149	R	92.8	Very high	92.3	Very high	103 Å²	103	80.3 Å²	80.3	39%	0.389	42%	0.415	S	S	.	.	H	α-helix	trans	-73.1	-34.8	173	-73.6	173.7	178	-178.3	-3.8	113	R145 A146 I147	R145-R149 WeakPolarHBondContact O-CG 3.5Å; R145-R149 PolarHBondContact O-N 3.41Å; A146-R149 WeakPolarHBondContact O-CB 3.37Å; A146-R149 PolarHBondContact O-N 2.75Å; A146-R149 VanDerWaalsContact O-N 3.13Å; I147-R149 VanDerWaalsContact C-N 3.27Å; I147-R149 PolarHBondContact O-N 2.93Å
150	I	93.3	Very high	92.5	Very high	3 Å²	3	74 Å²	74	2%	0.015	39%	0.392	C	S	.	.	H	α-helix	trans	-69.3	-47.4	177.6	-65.3	156.9	0	0	0	110.5	A146 I147 K158 V171 I176 I192 L195 I196	A146-I150 WeakPolarHBondContact O-CG1 3.24Å; A146-I150 PolarHBondContact O-N 2.85Å; A146-I150 VanDerWaalsContact O-N 3.07Å; I147-I150 PolarHBondContact O-N 3.13Å; I147-I150 VanDerWaalsContact O-N 3.09Å; I150-K158 PolarHBondContact O-N 2.72Å; I150-V171 HydrophobicContact CG2-CG2 4.15Å; I150-I176 HydrophobicContact CD1-CD1 3.63Å; I150-I192 HydrophobicContact CD1-CG2 4.28Å; I150-I192 HydrophobicContact CG1-CG2 4.35Å; I150-L195 HydrophobicContact CG1-CB 4.42Å; I150-I196 HydrophobicContact CD1-CD1 4.13Å; I150-I196 HydrophobicContact CD1-CG1 3.76Å; I150-I196 HydrophobicContact CG1-CG1 4.32Å
151	A	93	Very high	92.7	Very high	30 Å²	30	71.3 Å²	71.3	25%	0.248	36%	0.364	C	S	.	.	H	α-helix	trans	-66.6	-46.5	175.9	0	0	0	0	0	110.9	I147 G155 R156 T157 K158	I147-A151 PolarHBondContact O-N 3.2Å; A151-G155 CarbonylContact O-C 3.6Å; A151-G155 WeakPolarHBondContact O-CA 3.33Å; A151-R156 PolarHBondContact O-N 3.1Å; A151-T157 PolarHBondContact O-N 3.49Å; A151-K158 PolarHBondContact O-N 3.33Å
152	G	92.2	Very high	92.7	Very high	22 Å²	22	66 Å²	66	23%	0.227	34%	0.335	C	S	.	.			trans	71.1	-176.5	-168.8	0	0	0	0	0	111.9	G148 D154 G155 T157	G148-G152 WeakPolarHBondContact O-CA 3.37Å; G148-G152 PolarHBondContact O-N 3.32Å; G152-D154 PolarHBondContact O-N 3.46Å; G152-G155 PolarHBondContact O-N 2.99Å; G152-T157 WeakPolarHBondContact CA-OG1 3.16Å
153	K	92.8	Very high	92.7	Very high	175 Å²	175	64.8 Å²	64.8	76%	0.761	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-63.1	121.6	173.9	-173	179.6	177.8	-178.4	0	109.2	G155 R156	K153-G155 PolarHBondContact O-N 2.87Å; K153-G155 VanDerWaalsContact O-N 3.13Å; K153-R156 WeakPolarHBondContact O-CB 3.27Å; K153-R156 PolarHBondContact O-N 2.91Å
154	D	91.7	Very high	92.7	Very high	154 Å²	154	64.6 Å²	64.6	82%	0.824	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	53.7	28.7	179.6	-51.2	-43.9	0	0	0	114.7	G152 R156	G152-D154 PolarHBondContact O-N 3.46Å; D154-R156 VanDerWaalsContact C-N 3.27Å; D154-R156 PolarHBondContact O-N 3.2Å
155	G	91.3	Very high	92.6	Very high	23 Å²	23	60.9 Å²	60.9	24%	0.237	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	77.4	8.4	-177.9	0	0	0	0	0	114.5	A151 G152 K153 T157 K158 F159	A151-G155 CarbonylContact O-C 3.6Å; A151-G155 WeakPolarHBondContact O-CA 3.33Å; G152-G155 PolarHBondContact O-N 2.99Å; K153-G155 PolarHBondContact O-N 2.87Å; K153-G155 VanDerWaalsContact O-N 3.13Å; G155-T157 VanDerWaalsContact C-N 3.3Å; G155-T157 PolarHBondContact O-N 3.13Å; G155-K158 WeakPolarHBondContact O-CB 3.24Å; G155-K158 PolarHBondContact O-N 3.02Å; G155-F159 WeakPolarHBondContact O-CB 3.47Å; G155-F159 PolarHBondContact O-N 2.89Å
156	R	92.2	Very high	92.5	Very high	186 Å²	186	63.3 Å²	63.3	70%	0.702	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-37.6	-175.9	-172.9	174.7	-176.6	174.4	2.6	113.2	A151 K153 D154 T160	A151-R156 PolarHBondContact O-N 3.1Å; K153-R156 WeakPolarHBondContact O-CB 3.27Å; K153-R156 PolarHBondContact O-N 2.91Å; D154-R156 VanDerWaalsContact C-N 3.27Å; D154-R156 PolarHBondContact O-N 3.2Å; R156-T160 WeakPolarHBondContact O-CB 3.34Å; R156-T160 PolarHBondContact O-N 2.75Å; R156-T160 PolarHBondContact O-OG1 2.99Å
157	T	92.2	Very high	92.6	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-68.3	-47.8	179.3	-59.1	0	0	0	0	110.4	A151 G152 G155 F159 T160 I161 L195 Y205	A151-T157 PolarHBondContact O-N 3.49Å; G152-T157 WeakPolarHBondContact CA-OG1 3.16Å; G155-T157 VanDerWaalsContact C-N 3.3Å; G155-T157 PolarHBondContact O-N 3.13Å; T157-F159 PolarHBondContact O-N 3.47Å; T157-T160 PolarHBondContact O-N 2.64Å; T157-I161 HydrophobicContact CG2-CD1 4.25Å; T157-I161 WeakPolarHBondContact O-CG1 3.4Å; T157-I161 PolarHBondContact O-N 3.01Å; T157-L195 HydrophobicContact CG2-CD1 3.69Å; T157-Y205 WeakPolarHBondContact CA-OH 3.46Å; T157-Y205 WeakPolarHBondContact CB-OH 3.48Å; T157-Y205 HydrophobicContact CG2-CE1 3.97Å; T157-Y205 PolarHBondContact OG1-OH 3.36Å
158	K	93.2	Very high	92.6	Very high	59 Å²	59	66 Å²	66	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-53.5	-53.8	173.2	176.7	-166.5	165.7	-179.9	0	110.9	I150 A151 G155 T160 I161 E162 I169	I150-K158 PolarHBondContact O-N 2.72Å; A151-K158 PolarHBondContact O-N 3.33Å; G155-K158 WeakPolarHBondContact O-CB 3.24Å; G155-K158 PolarHBondContact O-N 3.02Å; K158-T160 VanDerWaalsContact C-N 3.3Å; K158-T160 PolarHBondContact O-N 3.46Å; K158-I161 PolarHBondContact O-N 3.13Å; K158-I161 VanDerWaalsContact O-N 3.11Å; K158-E162 VanDerWaalsContact CE-CD 3.49Å; K158-E162 WeakPolarHBondContact CE-OE1 3.12Å; K158-E162 HydrophobicContact CG-CG 4.35Å; K158-E162 IonicContact NZ-OE1 3.7Å; K158-E162 WeakPolarHBondContact O-CG 3.33Å; K158-E162 PolarHBondContact O-N 3.29Å; K158-I169 WeakPolarHBondContact CE-O 3.41Å; K158-I169 HydrophobicContact CG-CB 4.37Å; K158-I169 PolarHBondContact NZ-O 3.46Å
159	F	93.6	Very high	92.7	Very high	118 Å²	118	64.1 Å²	64.1	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-62.3	-36.3	-177.8	-171.8	-114.7	0	0	0	112.9	G155 T157 E162 N163	G155-F159 WeakPolarHBondContact O-CB 3.47Å; G155-F159 PolarHBondContact O-N 2.89Å; T157-F159 PolarHBondContact O-N 3.47Å; F159-E162 PolarHBondContact O-N 3.09Å; F159-N163 VanDerWaalsContact CD1-ND2 3.32Å; F159-N163 WeakPolarHBondContact CD1-ND2 3.32Å; F159-N163 WeakPolarHBondContact CE1-ND2 3.47Å; F159-N163 WeakPolarHBondContact CZ-ND2 3.47Å; F159-N163 WeakPolarHBondContact O-CB 2.98Å; F159-N163 VanDerWaalsContact O-CG 3.29Å; F159-N163 PolarHBondContact O-N 2.77Å; F159-N163 PolarHBondContact O-ND2 3.24Å
160	T	93.2	Very high	92.8	Very high	50 Å²	50	60.4 Å²	60.4	31%	0.307	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-42.3	175.6	-57.3	0	0	0	0	111.3	R156 T157 K158 A164 Y205	R156-T160 WeakPolarHBondContact O-CB 3.34Å; R156-T160 PolarHBondContact O-N 2.75Å; R156-T160 PolarHBondContact O-OG1 2.99Å; T157-T160 PolarHBondContact O-N 2.64Å; K158-T160 VanDerWaalsContact C-N 3.3Å; K158-T160 PolarHBondContact O-N 3.46Å; T160-A164 WeakPolarHBondContact O-CB 3.37Å; T160-A164 PolarHBondContact O-N 3.41Å; T160-Y205 HydrophobicContact CG2-CD1 3.75Å; T160-Y205 HydrophobicContact CG2-CE1 3.88Å
161	I	93.6	Very high	92.8	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-66.1	-50.1	176.5	-64.9	169.9	0	0	0	109.5	T157 K158 N163 A164 T165 I169 A188 A191 L195	T157-I161 HydrophobicContact CG2-CD1 4.25Å; T157-I161 WeakPolarHBondContact O-CG1 3.4Å; T157-I161 PolarHBondContact O-N 3.01Å; K158-I161 PolarHBondContact O-N 3.13Å; K158-I161 VanDerWaalsContact O-N 3.11Å; I161-N163 PolarHBondContact O-N 2.81Å; I161-A164 PolarHBondContact O-N 3.43Å; I161-A164 VanDerWaalsContact O-N 3.13Å; I161-T165 PolarHBondContact O-N 2.8Å; I161-T165 PolarHBondContact O-OG1 2.93Å; I161-I169 HydrophobicContact CB-CD1 4.33Å; I161-I169 HydrophobicContact CG2-CD1 3.8Å; I161-A188 HydrophobicContact CG2-CB 4.36Å; I161-A191 HydrophobicContact CD1-CB 4.25Å; I161-A191 HydrophobicContact CG2-CB 4.44Å; I161-L195 HydrophobicContact CD1-CD1 3.75Å
162	E	93.3	Very high	92.7	Very high	18 Å²	18	63 Å²	63	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-52.6	-49.2	180	-73.5	-179	149.5	0	0	113	K158 F159 A164 R166 T167 I169	K158-E162 VanDerWaalsContact CE-CD 3.49Å; K158-E162 WeakPolarHBondContact CE-OE1 3.12Å; K158-E162 HydrophobicContact CG-CG 4.35Å; K158-E162 IonicContact NZ-OE1 3.7Å; K158-E162 WeakPolarHBondContact O-CG 3.33Å; K158-E162 PolarHBondContact O-N 3.29Å; F159-E162 PolarHBondContact O-N 3.09Å; E162-A164 VanDerWaalsContact C-N 3.35Å; E162-A164 PolarHBondContact O-N 3.02Å; E162-R166 VanDerWaalsContact O-CA 3.29Å; E162-R166 WeakPolarHBondContact O-CA 3.48Å; E162-R166 PolarHBondContact O-N 3.12Å; E162-T167 WeakPolarHBondContact CA-O 3.32Å; E162-T167 VanDerWaalsContact CB-O 3.24Å; E162-T167 WeakPolarHBondContact CB-O 3.28Å; E162-T167 WeakPolarHBondContact CG-O 3.36Å; E162-T167 PolarHBondContact O-N 3.31Å; E162-T167 VanDerWaalsContact O-N 3.08Å; E162-I169 HydrophobicContact CG-CB 4.02Å; E162-I169 HydrophobicContact CG-CD1 3.8Å; E162-I169 HydrophobicContact CG-CG1 3.85Å; E162-I169 WeakPolarHBondContact OE1-CA 3.34Å; E162-I169 WeakPolarHBondContact OE1-CB 3.47Å; E162-I169 PolarHBondContact OE1-N 3Å; E162-I169 VanDerWaalsContact OE1-O 3.11Å
163	N	92.5	Very high	92.6	Very high	85 Å²	85	68.3 Å²	68.3	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-68.3	-36.4	-179.3	-69.5	-22.1	0	0	0	112.5	F159 I161	F159-N163 VanDerWaalsContact CD1-ND2 3.32Å; F159-N163 WeakPolarHBondContact CD1-ND2 3.32Å; F159-N163 WeakPolarHBondContact CE1-ND2 3.47Å; F159-N163 WeakPolarHBondContact CZ-ND2 3.47Å; F159-N163 WeakPolarHBondContact O-CB 2.98Å; F159-N163 VanDerWaalsContact O-CG 3.29Å; F159-N163 PolarHBondContact O-N 2.77Å; F159-N163 PolarHBondContact O-ND2 3.24Å; I161-N163 PolarHBondContact O-N 2.81Å
164	A	92	Very high	92.5	Very high	28 Å²	28	61.4 Å²	61.4	23%	0.231	31%	0.307	C	S	.	.	H	α-helix	trans	-74.6	-38.7	-177.1	0	0	0	0	0	112.1	T160 I161 E162 V208 S212	T160-A164 WeakPolarHBondContact O-CB 3.37Å; T160-A164 PolarHBondContact O-N 3.41Å; I161-A164 PolarHBondContact O-N 3.43Å; I161-A164 VanDerWaalsContact O-N 3.13Å; E162-A164 VanDerWaalsContact C-N 3.35Å; E162-A164 PolarHBondContact O-N 3.02Å; A164-V208 HydrophobicContact CB-CG1 3.25Å; A164-S212 WeakPolarHBondContact CA-OG 3.49Å; A164-S212 WeakPolarHBondContact CB-OG 3.05Å; A164-S212 WeakPolarHBondContact O-CB 3.45Å; A164-S212 PolarHBondContact O-OG 2.9Å
165	T	90.7	Very high	92.6	Very high	4 Å²	4	58.5 Å²	58.5	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-91.8	-4.5	177.9	52.1	0	0	0	0	113.5	I161 T167 N184 A188	I161-T165 PolarHBondContact O-N 2.8Å; I161-T165 PolarHBondContact O-OG1 2.93Å; T165-T167 VanDerWaalsContact C-N 3.25Å; T165-T167 PolarHBondContact O-N 3.14Å; T165-T167 PolarHBondContact OG1-OG1 3.3Å; T165-N184 VanDerWaalsContact O-CB 3.26Å; T165-N184 WeakPolarHBondContact O-CB 3.37Å; T165-N184 PolarHBondContact O-ND2 2.87Å; T165-A188 HydrophobicContact CG2-CB 4.24Å
166	R	90.7	Very high	92.7	Very high	178 Å²	178	57.4 Å²	57.4	67%	0.672	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	43.9	-172.1	-55.5	179.6	-178.1	170.4	1.1	111.8	E162	E162-R166 VanDerWaalsContact O-CA 3.29Å; E162-R166 WeakPolarHBondContact O-CA 3.48Å; E162-R166 PolarHBondContact O-N 3.12Å
167	T	93.7	Very high	92.9	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	25%	0.245	C	C	.	.			trans	-119.4	159.4	178.4	56.9	0	0	0	0	110.5	E162 T165 I178 L179 N184 A188	E162-T167 WeakPolarHBondContact CA-O 3.32Å; E162-T167 VanDerWaalsContact CB-O 3.24Å; E162-T167 WeakPolarHBondContact CB-O 3.28Å; E162-T167 WeakPolarHBondContact CG-O 3.36Å; E162-T167 PolarHBondContact O-N 3.31Å; E162-T167 VanDerWaalsContact O-N 3.08Å; T165-T167 VanDerWaalsContact C-N 3.25Å; T165-T167 PolarHBondContact O-N 3.14Å; T165-T167 PolarHBondContact OG1-OG1 3.3Å; T167-I178 HydrophobicContact CG2-CG2 4.23Å; T167-L179 CarbonylContact C-O 3.58Å; T167-L179 VanDerWaalsContact CA-O 3.27Å; T167-L179 WeakPolarHBondContact CA-O 3.41Å; T167-L179 VanDerWaalsContact CB-O 3.32Å; T167-L179 WeakPolarHBondContact CB-O 3.28Å; T167-N184 HydrophobicContact CG2-CB 3.74Å; T167-A188 HydrophobicContact CG2-CB 4.3Å
168	R	94.5	Very high	93	Very high	97 Å²	97	48.9 Å²	48.9	37%	0.366	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	136	166.9	-60	-61.1	-167	-157.6	-0.6	109.4	F111 D115 I178 L179	F111-R168 HydrophobicContact CD1-CB 3.96Å; F111-R168 HydrophobicContact CE1-CB 3.74Å; F111-R168 WeakPolarHBondContact CE1-O 3.32Å; D115-R168 HydrophobicContact CB-CG 4.05Å; D115-R168 IonicContact OD1-CZ 3.54Å; D115-R168 IonicContact OD1-NE 3.92Å; D115-R168 PolarHBondContact OD1-NE 3.2Å; D115-R168 IonicContact OD1-NH2 3.55Å; D115-R168 IonicContact OD2-NE 2.74Å; R168-I178 CarbonylContact O-C 3.41Å; R168-I178 WeakPolarHBondContact O-CA 3.46Å; R168-L179 HydrophobicContact CB-CB 4.3Å; R168-L179 HydrophobicContact CB-CD2 4.38Å; R168-L179 HydrophobicContact CG-CD2 4.38Å; R168-L179 PolarHBondContact N-O 3.44Å; R168-L179 PolarHBondContact O-N 3.21Å
169	I	94.8	Very high	93.1	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.6	-177.3	-59.6	168.3	0	0	0	108.2	K158 I161 E162 V171 I176 H177 I178 I192	K158-I169 WeakPolarHBondContact CE-O 3.41Å; K158-I169 HydrophobicContact CG-CB 4.37Å; K158-I169 PolarHBondContact NZ-O 3.46Å; I161-I169 HydrophobicContact CB-CD1 4.33Å; I161-I169 HydrophobicContact CG2-CD1 3.8Å; E162-I169 HydrophobicContact CG-CB 4.02Å; E162-I169 HydrophobicContact CG-CD1 3.8Å; E162-I169 HydrophobicContact CG-CG1 3.85Å; E162-I169 WeakPolarHBondContact OE1-CA 3.34Å; E162-I169 WeakPolarHBondContact OE1-CB 3.47Å; E162-I169 PolarHBondContact OE1-N 3Å; E162-I169 VanDerWaalsContact OE1-O 3.11Å; I169-V171 HydrophobicContact CG2-CG2 4.21Å; I169-I176 HydrophobicContact CG2-CG2 3.83Å; I169-H177 CarbonylContact C-O 3.57Å; I169-H177 VanDerWaalsContact CA-O 3.3Å; I169-H177 WeakPolarHBondContact CA-O 2.88Å; I169-I178 HydrophobicContact CG1-CG1 4.46Å; I169-I178 HydrophobicContact CG1-CG2 4.33Å; I169-I192 HydrophobicContact CD1-CD1 4.11Å
170	V	94.2	Very high	93.1	Very high	25 Å²	25	40.8 Å²	40.8	15%	0.152	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.6	169.6	177.6	0	0	0	0	107.3	F111 I176 H177	F111-V170 HydrophobicContact CD1-CG2 3.6Å; F111-V170 HydrophobicContact CD2-CG2 4.37Å; F111-V170 HydrophobicContact CE1-CG2 3.65Å; F111-V170 HydrophobicContact CE2-CG2 4.42Å; F111-V170 HydrophobicContact CG-CG2 3.97Å; F111-V170 HydrophobicContact CZ-CG2 4.07Å; V170-I176 CarbonylContact O-C 3.06Å; V170-I176 WeakPolarHBondContact O-CA 3.3Å; V170-H177 HydrophobicContact CB-CB 4.29Å; V170-H177 PolarHBondContact N-O 3.1Å; V170-H177 PolarHBondContact O-N 3.27Å
171	V	93.4	Very high	93.1	Very high	45 Å²	45	40.4 Å²	40.4	27%	0.273	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.9	178.5	-177.7	0	0	0	0	107	I147 I150 I169	I147-V171 HydrophobicContact CG2-CG1 4.09Å; I150-V171 HydrophobicContact CG2-CG2 4.15Å; I169-V171 HydrophobicContact CG2-CG2 4.21Å
172	A	91.7	Very high	93	Very high	42 Å²	42	47.6 Å²	47.6	35%	0.347	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	80.7	-178.8	0	0	0	0	0	109.3	S174 K175	A172-S174 PolarHBondContact O-N 2.84Å; A172-K175 CarbonylContact C-O 3.51Å; A172-K175 WeakPolarHBondContact CA-O 3.44Å; A172-K175 PolarHBondContact N-O 3.48Å; A172-K175 PolarHBondContact O-N 3.23Å
173	D	89.3	Confident	92.9	Very high	133 Å²	133	51.5 Å²	51.5	71%	0.711	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	-101	-175.9	-56.7	-40.8	0	0	0	112.4	I147	I147-D173 WeakPolarHBondContact CD1-O 3.31Å; I147-D173 WeakPolarHBondContact CG1-O 3.09Å
174	S	91.5	Very high	92.9	Very high	30 Å²	30	48.4 Å²	48.4	21%	0.21	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-18.8	178.3	58.8	0	0	0	0	114.2	E131 V132 A172	E131-S174 WeakPolarHBondContact CA-O 3.47Å; V132-S174 WeakPolarHBondContact CG2-O 3.29Å; V132-S174 PolarHBondContact N-O 3.5Å; A172-S174 PolarHBondContact O-N 2.84Å
175	K	93.3	Very high	93	Very high	93 Å²	93	47.2 Å²	47.2	40%	0.404	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	135.8	-177.4	-54.4	-163.8	-176.2	-134.2	0	110.3	E131 A172	E131-K175 HydrophobicContact CG-CG 4.21Å; E131-K175 WeakPolarHBondContact OE1-CE 3.42Å; E131-K175 IonicContact OE1-NZ 2.66Å; E131-K175 PolarHBondContact OE1-NZ 3.05Å; A172-K175 CarbonylContact C-O 3.51Å; A172-K175 WeakPolarHBondContact CA-O 3.44Å; A172-K175 PolarHBondContact N-O 3.48Å; A172-K175 PolarHBondContact O-N 3.23Å
176	I	94.3	Very high	93.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.5	178.1	-53.8	171.1	0	0	0	106.9	F130 V132 I150 I169 V170 I178 I192 I196	F130-I176 HydrophobicContact CD1-CD1 4.35Å; F130-I176 PolarHBondContact N-O 3.28Å; F130-I176 PolarHBondContact O-N 3.39Å; V132-I176 HydrophobicContact CG2-CD1 3.8Å; V132-I176 HydrophobicContact CG2-CG1 4.31Å; I150-I176 HydrophobicContact CD1-CD1 3.63Å; I169-I176 HydrophobicContact CG2-CG2 3.83Å; V170-I176 CarbonylContact O-C 3.06Å; V170-I176 WeakPolarHBondContact O-CA 3.3Å; I176-I178 HydrophobicContact CG2-CG1 4.43Å; I176-I192 HydrophobicContact CD1-CG2 3.65Å; I176-I192 HydrophobicContact CG2-CD1 4.19Å; I176-I196 HydrophobicContact CD1-CD1 4.42Å
177	H	95.4	Very high	93.2	Very high	11 Å²	11	48 Å²	48	5%	0.051	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.9	177.2	-53.1	-64.6	0	0	0	109.3	L109 F111 E128 S129 I169 V170	L109-H177 PolarHBondContact O-CD2 2.7Å; F111-H177 HydrophobicContact CE2-CB 3.76Å; F111-H177 HydrophobicContact CZ-CB 3.85Å; E128-H177 CarbonylContact O-C 3.6Å; E128-H177 VanDerWaalsContact O-CA 3.27Å; E128-H177 WeakPolarHBondContact O-CA 3.38Å; S129-H177 WeakPolarHBondContact CB-ND1 3.32Å; S129-H177 PolarHBondContact OG-CE1 3.35Å; S129-H177 PolarHBondContact OG-ND1 3.07Å; I169-H177 CarbonylContact C-O 3.57Å; I169-H177 VanDerWaalsContact CA-O 3.3Å; I169-H177 WeakPolarHBondContact CA-O 2.88Å; V170-H177 HydrophobicContact CB-CB 4.29Å; V170-H177 PolarHBondContact N-O 3.1Å; V170-H177 PolarHBondContact O-N 3.27Å
178	I	95.4	Very high	93.2	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.1	179.2	-48.8	176.6	0	0	0	107.8	V127 E128 T167 R168 I169 I176 I185 A188 R189 I192	V127-I178 WeakPolarHBondContact CA-O 3.29Å; E128-I178 PolarHBondContact N-O 3.48Å; E128-I178 PolarHBondContact O-N 3.07Å; T167-I178 HydrophobicContact CG2-CG2 4.23Å; R168-I178 CarbonylContact O-C 3.41Å; R168-I178 WeakPolarHBondContact O-CA 3.46Å; I169-I178 HydrophobicContact CG1-CG1 4.46Å; I169-I178 HydrophobicContact CG1-CG2 4.33Å; I176-I178 HydrophobicContact CG2-CG1 4.43Å; I178-I185 HydrophobicContact CB-CG2 4.32Å; I178-I185 HydrophobicContact CG2-CB 4.43Å; I178-I185 HydrophobicContact CG2-CG1 4.01Å; I178-I185 HydrophobicContact CG2-CG2 4.22Å; I178-A188 HydrophobicContact CD1-CB 4.29Å; I178-A188 HydrophobicContact CG2-CB 4.16Å; I178-R189 HydrophobicContact CD1-CB 4.38Å; I178-I192 HydrophobicContact CD1-CD1 3.63Å; I178-I192 HydrophobicContact CG1-CD1 4.23Å
179	L	94.4	Very high	93.2	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.1	175.6	175.7	161.2	0	0	0	108.9	F111 L119 L125 F126 V127 T167 R168	F111-L179 HydrophobicContact CD1-CB 4.13Å; F111-L179 HydrophobicContact CD1-CD1 4.13Å; F111-L179 HydrophobicContact CD2-CD1 4.33Å; F111-L179 HydrophobicContact CE1-CB 3.51Å; F111-L179 HydrophobicContact CE1-CD1 4.34Å; F111-L179 HydrophobicContact CE2-CB 4.09Å; F111-L179 HydrophobicContact CG-CD1 4.14Å; F111-L179 HydrophobicContact CZ-CB 3.49Å; F111-L179 VanDerWaalsContact CZ-CB 3.49Å; L119-L179 HydrophobicContact CD1-CD1 3.89Å; L119-L179 HydrophobicContact CD2-CD1 4.35Å; L119-L179 HydrophobicContact CD2-CG 4.45Å; L119-L179 HydrophobicContact CG-CD1 4.07Å; L125-L179 HydrophobicContact CD2-CD2 3.43Å; L125-L179 VanDerWaalsContact CD2-CD2 3.43Å; L125-L179 HydrophobicContact CD2-CG 4.19Å; L125-L179 HydrophobicContact CG-CD2 3.95Å; L125-L179 HydrophobicContact CG-CG 4.48Å; F126-L179 WeakPolarHBondContact O-CA 3.36Å; V127-L179 HydrophobicContact CG2-CB 4.39Å; V127-L179 HydrophobicContact CG2-CD1 4.12Å; V127-L179 HydrophobicContact CG2-CG 4.26Å; T167-L179 CarbonylContact C-O 3.58Å; T167-L179 VanDerWaalsContact CA-O 3.27Å; T167-L179 WeakPolarHBondContact CA-O 3.41Å; T167-L179 VanDerWaalsContact CB-O 3.32Å; T167-L179 WeakPolarHBondContact CB-O 3.28Å; R168-L179 HydrophobicContact CB-CB 4.3Å; R168-L179 HydrophobicContact CB-CD2 4.38Å; R168-L179 HydrophobicContact CG-CD2 4.38Å; R168-L179 PolarHBondContact N-O 3.44Å; R168-L179 PolarHBondContact O-N 3.21Å
180	G	93.7	Very high	93.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.5	-177.4	-176.8	0	0	0	0	0	114.1	L125 F126 I185	L125-G180 VanDerWaalsContact CD1-C 3.45Å; F126-G180 PolarHBondContact N-O 3.44Å; F126-G180 PolarHBondContact O-N 3.27Å; G180-I185 WeakPolarHBondContact O-CD1 3.39Å
181	S	92.6	Very high	93.1	Very high	42 Å²	42	48.1 Å²	48.1	29%	0.294	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	154	168.8	-50.5	0	0	0	0	110.5	E183 N184 I185	S181-E183 VanDerWaalsContact C-N 3.34Å; S181-E183 PolarHBondContact O-N 2.83Å; S181-N184 PolarHBondContact O-N 3.17Å; S181-N184 VanDerWaalsContact O-N 3.09Å; S181-I185 WeakPolarHBondContact O-CG1 3.48Å; S181-I185 PolarHBondContact O-N 3.11Å
182	Y	92.4	Very high	93.1	Very high	152 Å²	152	46 Å²	46	60%	0.596	22%	0.221	S	C	*	.	H	α-helix	trans	-53.9	-45.3	-176	-179.3	-99.3	0	0	0	113.8	I185 R186	Y182-I185 PolarHBondContact O-N 3.07Å; Y182-R186 PolarHBondContact O-N 3.33Å; Y182-R186 VanDerWaalsContact O-N 3.08Å
183	E	91.4	Very high	93.2	Very high	100 Å²	100	45 Å²	45	47%	0.467	21%	0.212	S	C	.	.	H	α-helix	trans	-62	-47	177.3	-61	-162.1	155.3	0	0	111.6	S181 I185 R186 Y187 R218	S181-E183 VanDerWaalsContact C-N 3.34Å; S181-E183 PolarHBondContact O-N 2.83Å; E183-I185 PolarHBondContact O-N 2.75Å; E183-R186 WeakPolarHBondContact O-CB 3.5Å; E183-R186 PolarHBondContact O-N 3.36Å; E183-R186 VanDerWaalsContact O-N 3.17Å; E183-Y187 HydrophobicContact CB-CE2 4.22Å; E183-Y187 WeakPolarHBondContact O-CD2 3.44Å; E183-Y187 PolarHBondContact O-N 3.04Å; E183-R218 IonicContact OE1-NH1 2.61Å; E183-R218 IonicContact OE2-NH1 2.72Å; E183-R218 PolarHBondContact OE2-NH1 3.25Å
184	N	92.2	Very high	93.4	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-40.8	-178.9	-69.6	-9.4	0	0	0	112.2	T165 T167 S181 R186 Y187 A188	T165-N184 VanDerWaalsContact O-CB 3.26Å; T165-N184 WeakPolarHBondContact O-CB 3.37Å; T165-N184 PolarHBondContact O-ND2 2.87Å; T167-N184 HydrophobicContact CG2-CB 3.74Å; S181-N184 PolarHBondContact O-N 3.17Å; S181-N184 VanDerWaalsContact O-N 3.09Å; N184-R186 VanDerWaalsContact C-N 3.32Å; N184-R186 PolarHBondContact O-N 3.29Å; N184-Y187 PolarHBondContact O-N 3.48Å; N184-A188 WeakPolarHBondContact O-CB 3.36Å; N184-A188 PolarHBondContact O-N 3.24Å
185	I	93.7	Very high	93.5	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-43.8	174.3	-67.1	168.8	0	0	0	110	F126 E128 I178 G180 S181 Y182 E183 Y187 A188 R189	F126-I185 HydrophobicContact CB-CD1 3.98Å; F126-I185 WeakPolarHBondContact O-CD1 2.91Å; E128-I185 HydrophobicContact CB-CG2 4Å; E128-I185 WeakPolarHBondContact OE2-CG2 3.27Å; I178-I185 HydrophobicContact CB-CG2 4.32Å; I178-I185 HydrophobicContact CG2-CB 4.43Å; I178-I185 HydrophobicContact CG2-CG1 4.01Å; I178-I185 HydrophobicContact CG2-CG2 4.22Å; G180-I185 WeakPolarHBondContact O-CD1 3.39Å; S181-I185 WeakPolarHBondContact O-CG1 3.48Å; S181-I185 PolarHBondContact O-N 3.11Å; Y182-I185 PolarHBondContact O-N 3.07Å; E183-I185 PolarHBondContact O-N 2.75Å; I185-Y187 VanDerWaalsContact C-N 3.32Å; I185-Y187 PolarHBondContact O-N 2.89Å; I185-A188 PolarHBondContact O-N 3.41Å; I185-R189 VanDerWaalsContact O-CB 3.29Å; I185-R189 WeakPolarHBondContact O-CB 3.44Å; I185-R189 PolarHBondContact O-N 3.04Å
186	R	93	Very high	93.4	Very high	141 Å²	141	34 Å²	34	53%	0.532	16%	0.156	S	C	.	.	H	α-helix	trans	-59.5	-42.9	177.6	-175.2	-179.2	179.4	-174.9	0.2	111.7	Y182 E183 N184 N190	Y182-R186 PolarHBondContact O-N 3.33Å; Y182-R186 VanDerWaalsContact O-N 3.08Å; E183-R186 WeakPolarHBondContact O-CB 3.5Å; E183-R186 PolarHBondContact O-N 3.36Å; E183-R186 VanDerWaalsContact O-N 3.17Å; N184-R186 VanDerWaalsContact C-N 3.32Å; N184-R186 PolarHBondContact O-N 3.29Å; R186-N190 WeakPolarHBondContact O-CB 3.46Å; R186-N190 PolarHBondContact O-N 2.97Å; R186-N190 PolarHBondContact O-ND2 3.36Å
187	Y	92.3	Very high	93.4	Very high	57 Å²	57	38.5 Å²	38.5	22%	0.224	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-44.7	176.5	-66.8	-58.9	0	0	0	112.4	E183 N184 I185 N190 A191 M211 I215	E183-Y187 HydrophobicContact CB-CE2 4.22Å; E183-Y187 WeakPolarHBondContact O-CD2 3.44Å; E183-Y187 PolarHBondContact O-N 3.04Å; N184-Y187 PolarHBondContact O-N 3.48Å; I185-Y187 VanDerWaalsContact C-N 3.32Å; I185-Y187 PolarHBondContact O-N 2.89Å; Y187-N190 PolarHBondContact O-N 3.09Å; Y187-A191 PolarHBondContact O-N 3.04Å; Y187-M211 HydrophobicContact CD1-CB 4.46Å; Y187-M211 HydrophobicContact CD1-CE 4.24Å; Y187-M211 HydrophobicContact CD1-CG 4.35Å; Y187-M211 HydrophobicContact CD1-SD 3.41Å; Y187-M211 WeakPolarHBondContact CD1-SD 3.42Å; Y187-M211 HydrophobicContact CE1-CG 4.44Å; Y187-M211 HydrophobicContact CE1-SD 3.85Å; Y187-M211 HydrophobicContact CG-SD 4.38Å; Y187-I215 HydrophobicContact CD2-CD1 3.64Å; Y187-I215 HydrophobicContact CE2-CD1 3.76Å; Y187-I215 HydrophobicContact CE2-CG1 4.15Å; Y187-I215 HydrophobicContact CG-CD1 4.44Å
188	A	93.8	Very high	93.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-44.3	176.7	0	0	0	0	0	111.6	I161 T165 T167 I178 N184 I185 N190 A191 I192	I161-A188 HydrophobicContact CG2-CB 4.36Å; T165-A188 HydrophobicContact CG2-CB 4.24Å; T167-A188 HydrophobicContact CG2-CB 4.3Å; I178-A188 HydrophobicContact CD1-CB 4.29Å; I178-A188 HydrophobicContact CG2-CB 4.16Å; N184-A188 WeakPolarHBondContact O-CB 3.36Å; N184-A188 PolarHBondContact O-N 3.24Å; I185-A188 PolarHBondContact O-N 3.41Å; A188-N190 PolarHBondContact O-N 3.27Å; A188-A191 WeakPolarHBondContact O-CB 3.26Å; A188-A191 PolarHBondContact O-N 3.03Å; A188-I192 WeakPolarHBondContact O-CG1 3.4Å; A188-I192 PolarHBondContact O-N 3.42Å
189	R	93.8	Very high	93.1	Very high	52 Å²	52	45.6 Å²	45.6	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-57	-50	175.3	-165.6	-166.2	-51.8	116.4	2.9	110.7	E128 I178 I185 A191 I192 C193	E128-R189 IonicContact OE1-CZ 3.84Å; E128-R189 IonicContact OE1-NE 2.6Å; E128-R189 PolarHBondContact OE1-NE 3.05Å; E128-R189 IonicContact OE1-NH2 3.63Å; E128-R189 PolarHBondContact OE1-NH2 3.03Å; E128-R189 IonicContact OE2-CZ 2.64Å; E128-R189 IonicContact OE2-NE 3.04Å; E128-R189 IonicContact OE2-NH2 3Å; E128-R189 PolarHBondContact OE2-NH2 2.69Å; I178-R189 HydrophobicContact CD1-CB 4.38Å; I185-R189 VanDerWaalsContact O-CB 3.29Å; I185-R189 WeakPolarHBondContact O-CB 3.44Å; I185-R189 PolarHBondContact O-N 3.04Å; R189-A191 VanDerWaalsContact C-N 3.28Å; R189-A191 PolarHBondContact O-N 3.34Å; R189-I192 PolarHBondContact O-N 2.89Å; R189-I192 VanDerWaalsContact O-N 3.14Å; R189-C193 WeakPolarHBondContact O-CB 3.43Å; R189-C193 PolarHBondContact O-N 3.14Å; R189-C193 PolarHBondContact O-SG 2.95Å
190	N	93.5	Very high	93	Very high	75 Å²	75	49 Å²	49	40%	0.401	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-37.3	179	-71	-17.1	0	0	0	112.9	R186 Y187 A188 S194	R186-N190 WeakPolarHBondContact O-CB 3.46Å; R186-N190 PolarHBondContact O-N 2.97Å; R186-N190 PolarHBondContact O-ND2 3.36Å; Y187-N190 PolarHBondContact O-N 3.09Å; A188-N190 PolarHBondContact O-N 3.27Å; N190-S194 VanDerWaalsContact O-CB 3.32Å; N190-S194 WeakPolarHBondContact O-CB 3.16Å; N190-S194 PolarHBondContact O-N 3.43Å; N190-S194 PolarHBondContact O-OG 2.83Å
191	A	93.5	Very high	92.8	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-44.4	175.1	0	0	0	0	0	111.7	I161 Y187 A188 R189 S194 L195 V204 V208	I161-A191 HydrophobicContact CD1-CB 4.25Å; I161-A191 HydrophobicContact CG2-CB 4.44Å; Y187-A191 PolarHBondContact O-N 3.04Å; A188-A191 WeakPolarHBondContact O-CB 3.26Å; A188-A191 PolarHBondContact O-N 3.03Å; R189-A191 VanDerWaalsContact C-N 3.28Å; R189-A191 PolarHBondContact O-N 3.34Å; A191-S194 WeakPolarHBondContact O-CB 3.48Å; A191-S194 PolarHBondContact O-N 2.91Å; A191-L195 WeakPolarHBondContact O-CG 3.29Å; A191-L195 PolarHBondContact O-N 3.29Å; A191-L195 VanDerWaalsContact O-N 3.12Å; A191-V204 HydrophobicContact CB-CG1 4.01Å; A191-V208 HydrophobicContact CB-CG2 3.59Å
192	I	94	Very high	92.8	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-46.8	176.6	-68.2	160.9	0	0	0	110.9	I150 I169 I176 I178 A188 R189 S194 L195 I196	I150-I192 HydrophobicContact CD1-CG2 4.28Å; I150-I192 HydrophobicContact CG1-CG2 4.35Å; I169-I192 HydrophobicContact CD1-CD1 4.11Å; I176-I192 HydrophobicContact CD1-CG2 3.65Å; I176-I192 HydrophobicContact CG2-CD1 4.19Å; I178-I192 HydrophobicContact CD1-CD1 3.63Å; I178-I192 HydrophobicContact CG1-CD1 4.23Å; A188-I192 WeakPolarHBondContact O-CG1 3.4Å; A188-I192 PolarHBondContact O-N 3.42Å; R189-I192 PolarHBondContact O-N 2.89Å; R189-I192 VanDerWaalsContact O-N 3.14Å; I192-S194 VanDerWaalsContact C-N 3.26Å; I192-S194 PolarHBondContact O-N 3.06Å; I192-L195 WeakPolarHBondContact O-CB 3.46Å; I192-L195 PolarHBondContact O-N 2.93Å; I192-I196 HydrophobicContact CG2-CD1 3.76Å; I192-I196 HydrophobicContact CG2-CG1 4.42Å; I192-I196 WeakPolarHBondContact O-CG1 3.36Å; I192-I196 PolarHBondContact O-N 3.3Å
193	C	93.3	Very high	92.7	Very high	21 Å²	21	53.6 Å²	53.6	14%	0.142	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-40.6	175.2	-60.9	0	0	0	0	111.3	V135 R189 L195 I196 L197	V135-C193 HydrophobicContact CG2-CB 4.14Å; V135-C193 VanDerWaalsContact CG2-SG 3.56Å; R189-C193 WeakPolarHBondContact O-CB 3.43Å; R189-C193 PolarHBondContact O-N 3.14Å; R189-C193 PolarHBondContact O-SG 2.95Å; C193-L195 VanDerWaalsContact C-N 3.32Å; C193-L195 PolarHBondContact O-N 2.66Å; C193-I196 PolarHBondContact O-N 3.01Å; C193-L197 WeakPolarHBondContact O-CB 3.02Å; C193-L197 VanDerWaalsContact O-CG 3.26Å; C193-L197 WeakPolarHBondContact O-CG 3.44Å; C193-L197 PolarHBondContact O-N 3.35Å
194	S	93.6	Very high	92.8	Very high	17 Å²	17	49 Å²	49	12%	0.119	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-39.7	175.5	-73.1	0	0	0	0	112.7	N190 A191 I192 G198 R199	N190-S194 VanDerWaalsContact O-CB 3.32Å; N190-S194 WeakPolarHBondContact O-CB 3.16Å; N190-S194 PolarHBondContact O-N 3.43Å; N190-S194 PolarHBondContact O-OG 2.83Å; A191-S194 WeakPolarHBondContact O-CB 3.48Å; A191-S194 PolarHBondContact O-N 2.91Å; I192-S194 VanDerWaalsContact C-N 3.26Å; I192-S194 PolarHBondContact O-N 3.06Å; S194-G198 PolarHBondContact O-N 3.31Å; S194-R199 VanDerWaalsContact O-CB 3.29Å; S194-R199 WeakPolarHBondContact O-CB 3.43Å; S194-R199 WeakPolarHBondContact O-CG 3.42Å; S194-R199 PolarHBondContact O-N 2.79Å; S194-R199 PolarHBondContact OG-NH1 3.03Å
195	L	93	Very high	92.7	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-41.2	176.1	-69.5	170.6	0	0	0	112	I150 T157 I161 A191 I192 C193 G198 P201 V204	I150-L195 HydrophobicContact CG1-CB 4.42Å; T157-L195 HydrophobicContact CG2-CD1 3.69Å; I161-L195 HydrophobicContact CD1-CD1 3.75Å; A191-L195 WeakPolarHBondContact O-CG 3.29Å; A191-L195 PolarHBondContact O-N 3.29Å; A191-L195 VanDerWaalsContact O-N 3.12Å; I192-L195 WeakPolarHBondContact O-CB 3.46Å; I192-L195 PolarHBondContact O-N 2.93Å; C193-L195 VanDerWaalsContact C-N 3.32Å; C193-L195 PolarHBondContact O-N 2.66Å; L195-G198 WeakPolarHBondContact O-CA 3.3Å; L195-G198 PolarHBondContact O-N 3.3Å; L195-P201 HydrophobicContact CD2-CB 4.44Å; L195-P201 HydrophobicContact CD2-CG 4.34Å; L195-V204 HydrophobicContact CD1-CG1 4.5Å; L195-V204 HydrophobicContact CD2-CB 4.16Å; L195-V204 HydrophobicContact CD2-CG1 4.36Å; L195-V204 HydrophobicContact CD2-CG2 3.75Å; L195-V204 HydrophobicContact CG-CB 4.49Å; L195-V204 HydrophobicContact CG-CG1 4.19Å; L195-V204 HydrophobicContact CG-CG2 4.08Å
196	I	93	Very high	92.6	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-42.7	177.1	-66	165.4	0	0	0	111.1	F130 V132 V135 K136 L138 I150 I176 I192 C193 G198	F130-I196 HydrophobicContact CE1-CD1 3.8Å; V132-I196 HydrophobicContact CB-CD1 4.47Å; V132-I196 HydrophobicContact CG1-CD1 4.15Å; V132-I196 HydrophobicContact CG1-CG1 4.3Å; V132-I196 HydrophobicContact CG1-CG2 3.93Å; V132-I196 HydrophobicContact CG2-CD1 4.14Å; V135-I196 HydrophobicContact CB-CG2 4.36Å; V135-I196 HydrophobicContact CG1-CB 4.27Å; V135-I196 HydrophobicContact CG1-CG2 3.84Å; K136-I196 HydrophobicContact CB-CG2 4.34Å; L138-I196 HydrophobicContact CD1-CG2 4.34Å; I150-I196 HydrophobicContact CD1-CD1 4.13Å; I150-I196 HydrophobicContact CD1-CG1 3.76Å; I150-I196 HydrophobicContact CG1-CG1 4.32Å; I176-I196 HydrophobicContact CD1-CD1 4.42Å; I192-I196 HydrophobicContact CG2-CD1 3.76Å; I192-I196 HydrophobicContact CG2-CG1 4.42Å; I192-I196 WeakPolarHBondContact O-CG1 3.36Å; I192-I196 PolarHBondContact O-N 3.3Å; C193-I196 PolarHBondContact O-N 3.01Å; I196-G198 PolarHBondContact O-N 3.08Å; I196-G198 VanDerWaalsContact O-N 3.16Å
197	L	92.6	Very high	92.4	Very high	96 Å²	96	49.4 Å²	49.4	50%	0.503	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.3	175.1	-69	173.9	0	0	0	112.9	V135 C193	V135-L197 HydrophobicContact CG1-CD2 3.93Å; V135-L197 HydrophobicContact CG1-CG 4.01Å; C193-L197 WeakPolarHBondContact O-CB 3.02Å; C193-L197 VanDerWaalsContact O-CG 3.26Å; C193-L197 WeakPolarHBondContact O-CG 3.44Å; C193-L197 PolarHBondContact O-N 3.35Å
198	G	91.6	Very high	92.3	Very high	31 Å²	31	46.8 Å²	46.8	32%	0.32	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	20.6	171.8	0	0	0	0	0	115.2	S194 L195 I196	S194-G198 PolarHBondContact O-N 3.31Å; L195-G198 WeakPolarHBondContact O-CA 3.3Å; L195-G198 PolarHBondContact O-N 3.3Å; I196-G198 PolarHBondContact O-N 3.08Å; I196-G198 VanDerWaalsContact O-N 3.16Å
199	R	92.8	Very high	92.1	Very high	132 Å²	132	56.3 Å²	56.3	50%	0.498	30%	0.3	S	S	.	.			trans	-63.1	142.5	170	-64	-177.2	176	170.2	-6	109.7	S194 V204	S194-R199 VanDerWaalsContact O-CB 3.29Å; S194-R199 WeakPolarHBondContact O-CB 3.43Å; S194-R199 WeakPolarHBondContact O-CG 3.42Å; S194-R199 PolarHBondContact O-N 2.79Å; S194-R199 PolarHBondContact OG-NH1 3.03Å; R199-V204 HydrophobicContact CB-CG2 4.22Å
200	P	92.3	Very high	91.8	Very high	77 Å²	77	56.6 Å²	56.6	50%	0.5	31%	0.31	S	S	.	.			trans	-63.2	139	179.4	24.9	-33.1	0	0	0	110.7	S202 K203 V204	P200-S202 PolarHBondContact O-N 3.36Å; P200-S202 VanDerWaalsContact O-N 3.14Å; P200-K203 HydrophobicContact CG-CB 4.06Å; P200-K203 PolarHBondContact O-N 3.07Å; P200-V204 PolarHBondContact O-N 3.28Å
201	P	91.4	Very high	91.4	Very high	48 Å²	48	54.6 Å²	54.6	31%	0.312	30%	0.299	S	S	.	.	H	α-helix	trans	-54.1	-35.7	-178.2	-28	34.8	0	0	0	113.7	L195 K203 V204 Y205	L195-P201 HydrophobicContact CD2-CB 4.44Å; L195-P201 HydrophobicContact CD2-CG 4.34Å; P201-K203 VanDerWaalsContact C-N 3.29Å; P201-K203 PolarHBondContact O-N 3.14Å; P201-V204 PolarHBondContact O-N 3.17Å; P201-V204 VanDerWaalsContact O-N 3.07Å; P201-Y205 HydrophobicContact CB-CE2 4.02Å; P201-Y205 VanDerWaalsContact O-CD2 3.3Å; P201-Y205 WeakPolarHBondContact O-CD2 3.44Å; P201-Y205 VanDerWaalsContact O-CG 3.28Å; P201-Y205 PolarHBondContact O-N 3.26Å
202	S	91.2	Very high	91	Very high	96 Å²	96	55.6 Å²	55.6	67%	0.671	31%	0.305	S	S	*	.	H	α-helix	trans	-56.8	-40.8	177.7	-47.5	0	0	0	0	112.8	P200 G206	P200-S202 PolarHBondContact O-N 3.36Å; P200-S202 VanDerWaalsContact O-N 3.14Å; S202-G206 PolarHBondContact O-N 3.29Å
203	K	91.7	Very high	90.6	Very high	148 Å²	148	57.7 Å²	57.7	64%	0.643	32%	0.323	S	S	*	.	H	α-helix	trans	-72	-35.9	177.8	-171.1	168.6	-174.7	169.8	0	111.4	P200 P201 G206 S207	P200-K203 HydrophobicContact CG-CB 4.06Å; P200-K203 PolarHBondContact O-N 3.07Å; P201-K203 VanDerWaalsContact C-N 3.29Å; P201-K203 PolarHBondContact O-N 3.14Å; K203-G206 PolarHBondContact O-N 2.98Å; K203-S207 PolarHBondContact O-N 3.19Å
204	V	92.4	Very high	90.3	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.03	35%	0.346	C	S	.	.	H	α-helix	trans	-65.8	-43.1	176.1	-178.9	0	0	0	0	110.5	A191 L195 R199 P200 P201 G206 S207 V208	A191-V204 HydrophobicContact CB-CG1 4.01Å; L195-V204 HydrophobicContact CD1-CG1 4.5Å; L195-V204 HydrophobicContact CD2-CB 4.16Å; L195-V204 HydrophobicContact CD2-CG1 4.36Å; L195-V204 HydrophobicContact CD2-CG2 3.75Å; L195-V204 HydrophobicContact CG-CB 4.49Å; L195-V204 HydrophobicContact CG-CG1 4.19Å; L195-V204 HydrophobicContact CG-CG2 4.08Å; R199-V204 HydrophobicContact CB-CG2 4.22Å; P200-V204 PolarHBondContact O-N 3.28Å; P201-V204 PolarHBondContact O-N 3.17Å; P201-V204 VanDerWaalsContact O-N 3.07Å; V204-G206 PolarHBondContact O-N 2.72Å; V204-S207 PolarHBondContact O-N 3.4Å; V204-V208 HydrophobicContact CG1-CG2 4.12Å; V204-V208 WeakPolarHBondContact O-CB 3.05Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.17Å; V204-V208 PolarHBondContact O-N 3.39Å
205	Y	90.9	Very high	89.7	Confident	68 Å²	68	64.6 Å²	64.6	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-42.3	175.3	-60.5	-35.3	0	0	0	112.8	T157 T160 P201 S207 V208 R209	T157-Y205 WeakPolarHBondContact CA-OH 3.46Å; T157-Y205 WeakPolarHBondContact CB-OH 3.48Å; T157-Y205 HydrophobicContact CG2-CE1 3.97Å; T157-Y205 PolarHBondContact OG1-OH 3.36Å; T160-Y205 HydrophobicContact CG2-CD1 3.75Å; T160-Y205 HydrophobicContact CG2-CE1 3.88Å; P201-Y205 HydrophobicContact CB-CE2 4.02Å; P201-Y205 VanDerWaalsContact O-CD2 3.3Å; P201-Y205 WeakPolarHBondContact O-CD2 3.44Å; P201-Y205 VanDerWaalsContact O-CG 3.28Å; P201-Y205 PolarHBondContact O-N 3.26Å; Y205-S207 VanDerWaalsContact C-N 3.34Å; Y205-S207 PolarHBondContact O-N 2.97Å; Y205-V208 PolarHBondContact O-N 3.13Å; Y205-R209 VanDerWaalsContact O-CB 3.27Å; Y205-R209 WeakPolarHBondContact O-CB 3.42Å; Y205-R209 PolarHBondContact O-N 2.82Å
206	G	90.5	Very high	89.2	Confident	43 Å²	43	67.1 Å²	67.1	44%	0.443	37%	0.366	S	S	.	.	H	α-helix	trans	-60	-43.7	174.8	0	0	0	0	0	112.3	S202 K203 V204 S210	S202-G206 PolarHBondContact O-N 3.29Å; K203-G206 PolarHBondContact O-N 2.98Å; V204-G206 PolarHBondContact O-N 2.72Å; G206-S210 PolarHBondContact O-N 3.16Å; G206-S210 VanDerWaalsContact O-N 3.1Å; G206-S210 PolarHBondContact O-OG 3.37Å
207	S	90.2	Very high	88.8	Confident	59 Å²	59	74.1 Å²	74.1	41%	0.413	40%	0.398	S	S	.	.	H	α-helix	trans	-66.2	-42.7	176.5	-171.8	0	0	0	0	112.6	K203 V204 Y205 S210 M211	K203-S207 PolarHBondContact O-N 3.19Å; V204-S207 PolarHBondContact O-N 3.4Å; Y205-S207 VanDerWaalsContact C-N 3.34Å; Y205-S207 PolarHBondContact O-N 2.97Å; S207-S210 PolarHBondContact O-OG 2.92Å; S207-M211 WeakPolarHBondContact O-CE 3.46Å; S207-M211 VanDerWaalsContact O-CG 3.24Å; S207-M211 WeakPolarHBondContact O-CG 3.41Å; S207-M211 PolarHBondContact O-N 3.07Å; S207-M211 VanDerWaalsContact O-N 3.15Å
208	V	89.6	Confident	88	Confident	3 Å²	3	76.8 Å²	76.8	2%	0.018	40%	0.402	C	S	.	.	H	α-helix	trans	-67.6	-44.1	-179.2	169.5	0	0	0	0	109.9	A164 A191 V204 Y205 S210 M211 S212	A164-V208 HydrophobicContact CB-CG1 3.25Å; A191-V208 HydrophobicContact CB-CG2 3.59Å; V204-V208 HydrophobicContact CG1-CG2 4.12Å; V204-V208 WeakPolarHBondContact O-CB 3.05Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.17Å; V204-V208 PolarHBondContact O-N 3.39Å; Y205-V208 PolarHBondContact O-N 3.13Å; V208-S210 PolarHBondContact O-N 3.34Å; V208-M211 HydrophobicContact CG2-CE 4.32Å; V208-M211 PolarHBondContact O-N 3.13Å; V208-S212 PolarHBondContact O-N 3.05Å; V208-S212 PolarHBondContact O-OG 3.48Å
209	R	88.6	Confident	86.4	Confident	200 Å²	200	86 Å²	86	76%	0.755	43%	0.434	S	S	*	.	H	α-helix	trans	-61.8	-43	177.7	-175.5	-179.3	-73.1	-176.6	-4.6	112.6	Y205 M211 S212 A213	Y205-R209 VanDerWaalsContact O-CB 3.27Å; Y205-R209 WeakPolarHBondContact O-CB 3.42Å; Y205-R209 PolarHBondContact O-N 2.82Å; R209-M211 VanDerWaalsContact C-N 3.32Å; R209-M211 PolarHBondContact O-N 3.46Å; R209-S212 PolarHBondContact O-N 2.89Å; R209-A213 PolarHBondContact O-N 2.86Å
210	S	88.7	Confident	86.1	Confident	58 Å²	58	83.8 Å²	83.8	41%	0.406	43%	0.43	S	S	.	.	H	α-helix	trans	-67.2	-34.5	178.2	63.7	0	0	0	0	112.4	G206 S207 V208 R214	G206-S210 PolarHBondContact O-N 3.16Å; G206-S210 VanDerWaalsContact O-N 3.1Å; G206-S210 PolarHBondContact O-OG 3.37Å; S207-S210 PolarHBondContact O-OG 2.92Å; V208-S210 PolarHBondContact O-N 3.34Å; S210-R214 WeakPolarHBondContact O-CG 3.33Å; S210-R214 PolarHBondContact O-N 3.05Å
211	M	85.3	Confident	85.8	Confident	32 Å²	32	84.1 Å²	84.1	16%	0.158	43%	0.427	C	S	.	.	H	α-helix	trans	-69.7	-43	173	-68.6	-176.3	-57.2	0	0	111.7	Y187 S207 V208 R209 A213 R214 I215	Y187-M211 HydrophobicContact CD1-CB 4.46Å; Y187-M211 HydrophobicContact CD1-CE 4.24Å; Y187-M211 HydrophobicContact CD1-CG 4.35Å; Y187-M211 HydrophobicContact CD1-SD 3.41Å; Y187-M211 WeakPolarHBondContact CD1-SD 3.42Å; Y187-M211 HydrophobicContact CE1-CG 4.44Å; Y187-M211 HydrophobicContact CE1-SD 3.85Å; Y187-M211 HydrophobicContact CG-SD 4.38Å; S207-M211 WeakPolarHBondContact O-CE 3.46Å; S207-M211 VanDerWaalsContact O-CG 3.24Å; S207-M211 WeakPolarHBondContact O-CG 3.41Å; S207-M211 PolarHBondContact O-N 3.07Å; S207-M211 VanDerWaalsContact O-N 3.15Å; V208-M211 HydrophobicContact CG2-CE 4.32Å; V208-M211 PolarHBondContact O-N 3.13Å; R209-M211 VanDerWaalsContact C-N 3.32Å; R209-M211 PolarHBondContact O-N 3.46Å; M211-A213 VanDerWaalsContact C-N 3.33Å; M211-A213 PolarHBondContact O-N 3.09Å; M211-R214 WeakPolarHBondContact O-CB 3.35Å; M211-R214 PolarHBondContact O-N 3.3Å; M211-I215 WeakPolarHBondContact O-CG1 3.38Å; M211-I215 PolarHBondContact O-N 3.42Å
212	S	83.6	Confident	85.5	Confident	25 Å²	25	86.1 Å²	86.1	18%	0.175	43%	0.433	C	S	.	.	H	α-helix	trans	-61	-39.6	176.6	-60.7	0	0	0	0	112.9	A164 V208 R209 R214 I215 A216	A164-S212 WeakPolarHBondContact CA-OG 3.49Å; A164-S212 WeakPolarHBondContact CB-OG 3.05Å; A164-S212 WeakPolarHBondContact O-CB 3.45Å; A164-S212 PolarHBondContact O-OG 2.9Å; V208-S212 PolarHBondContact O-N 3.05Å; V208-S212 PolarHBondContact O-OG 3.48Å; R209-S212 PolarHBondContact O-N 2.89Å; S212-R214 VanDerWaalsContact C-N 3.34Å; S212-R214 PolarHBondContact O-N 3.24Å; S212-I215 PolarHBondContact O-N 3.02Å; S212-A216 WeakPolarHBondContact O-CB 3.39Å; S212-A216 PolarHBondContact O-N 3.08Å
213	A	86.2	Confident	85.1	Confident	46 Å²	46	85.5 Å²	85.5	38%	0.38	42%	0.419	S	S	.	.	H	α-helix	trans	-59.2	-45.6	174.4	0	0	0	0	0	111.2	R209 M211 I215 A216 E217	R209-A213 PolarHBondContact O-N 2.86Å; M211-A213 VanDerWaalsContact C-N 3.33Å; M211-A213 PolarHBondContact O-N 3.09Å; A213-I215 PolarHBondContact O-N 3.46Å; A213-A216 PolarHBondContact O-N 2.91Å; A213-E217 WeakPolarHBondContact O-CG 3.4Å; A213-E217 PolarHBondContact O-N 3.35Å
214	R	86.5	Confident	84.7	Confident	166 Å²	166	81.6 Å²	81.6	63%	0.626	41%	0.405	S	S	*	.	H	α-helix	trans	-64.5	-36.6	176.4	-67.8	173.4	-178.2	-170.7	-1	113.5	S210 M211 S212 A216 E217 R218	S210-R214 WeakPolarHBondContact O-CG 3.33Å; S210-R214 PolarHBondContact O-N 3.05Å; M211-R214 WeakPolarHBondContact O-CB 3.35Å; M211-R214 PolarHBondContact O-N 3.3Å; S212-R214 VanDerWaalsContact C-N 3.34Å; S212-R214 PolarHBondContact O-N 3.24Å; R214-A216 VanDerWaalsContact C-N 3.34Å; R214-E217 PolarHBondContact O-N 3.43Å; R214-R218 WeakPolarHBondContact O-CG 3.27Å; R214-R218 PolarHBondContact O-N 3.33Å
215	I	82.8	Confident	84.2	Confident	16 Å²	16	86.7 Å²	86.7	8%	0.082	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-39.1	176.9	-66.1	163.7	0	0	0	109.9	Y187 M211 S212 A213 R218	Y187-I215 HydrophobicContact CD2-CD1 3.64Å; Y187-I215 HydrophobicContact CE2-CD1 3.76Å; Y187-I215 HydrophobicContact CE2-CG1 4.15Å; Y187-I215 HydrophobicContact CG-CD1 4.44Å; M211-I215 WeakPolarHBondContact O-CG1 3.38Å; M211-I215 PolarHBondContact O-N 3.42Å; S212-I215 PolarHBondContact O-N 3.02Å; A213-I215 PolarHBondContact O-N 3.46Å; I215-R218 PolarHBondContact O-N 3.13Å
216	A	81.6	Confident	83.7	Confident	54 Å²	54	88.1 Å²	88.1	45%	0.446	44%	0.442	S	S	.	.	H	α-helix	trans	-68.4	-32.6	176.8	0	0	0	0	0	112.7	S212 A213 R214 R218	S212-A216 WeakPolarHBondContact O-CB 3.39Å; S212-A216 PolarHBondContact O-N 3.08Å; A213-A216 PolarHBondContact O-N 2.91Å; R214-A216 VanDerWaalsContact C-N 3.34Å; A216-R218 VanDerWaalsContact C-N 3.31Å; A216-R218 PolarHBondContact O-N 3.3Å
217	E	84.7	Confident	83.2	Confident	154 Å²	154	91.5 Å²	91.5	72%	0.72	44%	0.441	S	S	*	.	H	α-helix	trans	-73.9	-16.7	177.2	-74.5	169.4	-176.2	0	0	114.3	A213 R214 F219	A213-E217 WeakPolarHBondContact O-CG 3.4Å; A213-E217 PolarHBondContact O-N 3.35Å; R214-E217 PolarHBondContact O-N 3.43Å; E217-F219 VanDerWaalsContact C-N 3.25Å; E217-F219 PolarHBondContact O-N 2.99Å
218	R	75.8	Confident	82.6	Confident	151 Å²	151	94.3 Å²	94.3	57%	0.57	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.5	-178.9	-81.2	177.6	177.8	-167.2	-4.1	114	E183 R214 I215 A216	E183-R218 IonicContact OE1-NH1 2.61Å; E183-R218 IonicContact OE2-NH1 2.72Å; E183-R218 PolarHBondContact OE2-NH1 3.25Å; R214-R218 WeakPolarHBondContact O-CG 3.27Å; R214-R218 PolarHBondContact O-N 3.33Å; I215-R218 PolarHBondContact O-N 3.13Å; A216-R218 VanDerWaalsContact C-N 3.31Å; A216-R218 PolarHBondContact O-N 3.3Å
219	F	58.3	Low	82	Confident	226 Å²	226	102.5 Å²	102.5	99%	0.991	48%	0.483	S	S	*	.			trans	-128.3	0	-177.7	-63.6	-79	0	0	0	109.8	E217	E217-F219 VanDerWaalsContact C-N 3.25Å; E217-F219 PolarHBondContact O-N 2.99Å

Retrieved 219 of 219 residues in 178.9 ms (Link to these results)

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