A0A077Z377_TRITR Loading...

Repulsive guidance molecule A

AlphaFold DB , UniProt , Accession A0A077Z377, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 298 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	40	Very low	37.5	Very low	248 Å²	248	143.5 Å²	143.5	100%	1.222	85%	0.852	S	S	*	*				0	115.9	0	-83.4	153.6	116.9	0	0	108.1
2	G	40.9	Very low	37.2	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	85%	0.852	S	S	*	*			trans	51.4	96.1	166.9	0	0	0	0	0	117
3	Q	34.1	Very low	36.6	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.804	85%	0.853	S	S	*	*				59.6	100.5	58.8	-143.5	-180	-2.3	0	0	113.2
4	R	40.2	Very low	36.4	Very low	251 Å²	251	143.4 Å²	143.4	95%	0.947	85%	0.846	S	S	*	*			trans	-155	106.6	142.1	-120.5	177.1	-178.6	170.4	0.4	111.3
5	E	40.6	Very low	35.8	Very low	167 Å²	167	140.5 Å²	140.5	78%	0.78	85%	0.845	S	S	*	*			trans	-67.9	156.8	164	-65.5	162.8	93.8	0	0	110.4
6	G	35.5	Very low	35.7	Very low	69 Å²	69	137.6 Å²	137.6	71%	0.711	84%	0.84	S	S	*	*			trans	-176.5	58.8	-179.3	0	0	0	0	0	116.4
7	V	38.4	Very low	35.2	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	83%	0.834	S	S	*	*			trans	60.7	112.5	138.5	-172.4	0	0	0	0	119.3
8	A	30.9	Very low	35.3	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	83%	0.832	S	S	*	*			trans	-69.1	141.9	162.1	0	0	0	0	0	112.2
9	A	40.3	Very low	35.4	Very low	101 Å²	101	134.3 Å²	134.3	84%	0.835	83%	0.828	S	S	*	*			trans	-123.7	110.9	162.7	0	0	0	0	0	108.9
10	D	31.7	Very low	35	Very low	163 Å²	163	131.4 Å²	131.4	87%	0.872	83%	0.826	S	S	*	*			trans	-64	127.6	171.8	-123.2	-66.7	0	0	0	110.7
11	A	39.4	Very low	34.9	Very low	91 Å²	91	133.8 Å²	133.8	75%	0.752	83%	0.826	S	S	*	*			trans	-141.4	75.7	167.2	0	0	0	0	0	110.5	V13	A11-V13 PolarHBondContact O-N 3.28Å
12	K	34.3	Very low	34.4	Very low	196 Å²	196	133 Å²	133	85%	0.852	81%	0.81	S	S	*	*			trans	11.9	96	145.2	-147.7	173.3	-171.4	-177.7	0	116.6	A14	K12-A14 PolarHBondContact O-N 3.5Å
13	V	29.5	Very low	34	Very low	141 Å²	141	138.4 Å²	138.4	86%	0.855	81%	0.814	S	S	*	*			trans	-74.9	104.1	162.6	174.7	0	0	0	0	108.6	A11 A15	A11-V13 PolarHBondContact O-N 3.28Å; V13-A15 PolarHBondContact O-N 3.01Å
14	A	34.4	Very low	34	Very low	92 Å²	92	137.5 Å²	137.5	76%	0.76	81%	0.81	S	S	*	*			trans	-85.8	100.9	166.7	0	0	0	0	0	108.6	K12 A16	K12-A14 PolarHBondContact O-N 3.5Å; A14-A16 PolarHBondContact O-N 2.67Å; A14-A16 VanDerWaalsContact O-N 3.08Å
15	A	27.3	Very low	33.6	Very low	100 Å²	100	131 Å²	131	83%	0.826	80%	0.804	S	S	*	*			trans	-69.6	97.6	169.8	0	0	0	0	0	109.4	V13	V13-A15 PolarHBondContact O-N 3.01Å
16	A	33.7	Very low	33.2	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	81%	0.805	S	S	*	*			trans	-87.2	111	167.2	0	0	0	0	0	109	A14	A14-A16 PolarHBondContact O-N 2.67Å; A14-A16 VanDerWaalsContact O-N 3.08Å
17	S	26.5	Very low	33.1	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	80%	0.799	S	S	*	*			trans	-63.5	127.8	171	-176.1	0	0	0	0	110.5	T19	S17-T19 PolarHBondContact O-N 3.16Å
18	P	37.2	Very low	32.8	Very low	124 Å²	124	130 Å²	130	81%	0.805	80%	0.8	S	S	*	*			trans	-88	100.2	168.8	21.6	-8.2	0	0	0	108.9
19	T	37	Very low	33.1	Very low	123 Å²	123	133.1 Å²	133.1	76%	0.755	80%	0.798	S	S	*	*			trans	-54.4	132.6	160.6	39.9	0	0	0	0	110.8	S17 H21	S17-T19 PolarHBondContact O-N 3.16Å; T19-H21 PolarHBondContact O-N 2.79Å
20	G	28	Very low	33	Very low	76 Å²	76	132.2 Å²	132.2	78%	0.784	78%	0.784	S	S	*	*			trans	-23.2	110.2	178.3	0	0	0	0	0	117.1
21	H	32.5	Very low	33.6	Very low	181 Å²	181	129.5 Å²	129.5	84%	0.838	78%	0.776	S	S	*	*			trans	-122.7	125.8	149.3	-93	-85	0	0	0	109.1	T19 E23	T19-H21 PolarHBondContact O-N 2.79Å; H21-E23 VanDerWaalsContact C-N 3.31Å; H21-E23 PolarHBondContact O-N 3.07Å
22	R	29.3	Very low	33.6	Very low	232 Å²	232	132.6 Å²	132.6	88%	0.875	78%	0.779	S	S	*	*			trans	-64.8	84.6	177.4	-177.2	179.8	-176.6	165.3	-0.4	108.9	Q24	R22-Q24 PolarHBondContact O-N 3.02Å; R22-Q24 VanDerWaalsContact O-N 3.17Å
23	E	33.1	Very low	34.2	Very low	190 Å²	190	131.6 Å²	131.6	89%	0.888	78%	0.777	S	S	*	*			trans	-72	104.5	168.8	-106.2	179.8	88.2	0	0	108.8	H21 S25	H21-E23 VanDerWaalsContact C-N 3.31Å; H21-E23 PolarHBondContact O-N 3.07Å; E23-S25 PolarHBondContact O-N 2.82Å; E23-S25 VanDerWaalsContact O-N 3.08Å
24	Q	34	Very low	34.8	Very low	153 Å²	153	129.3 Å²	129.3	72%	0.715	77%	0.767	S	S	*	*			trans	-62.1	108.3	163.9	-75.2	173.1	-0.2	0	0	107.2	R22 L26	R22-Q24 PolarHBondContact O-N 3.02Å; R22-Q24 VanDerWaalsContact O-N 3.17Å; Q24-L26 VanDerWaalsContact C-N 3.32Å; Q24-L26 PolarHBondContact O-N 3.12Å
25	S	31.1	Very low	35.4	Very low	116 Å²	116	130.2 Å²	130.2	81%	0.811	77%	0.766	S	S	*	*			trans	-57.3	98.1	166.8	-161.4	0	0	0	0	107.9	E23 A27	E23-S25 PolarHBondContact O-N 2.82Å; E23-S25 VanDerWaalsContact O-N 3.08Å; S25-A27 PolarHBondContact O-N 3.49Å
26	L	33	Very low	36.4	Very low	155 Å²	155	131.6 Å²	131.6	81%	0.812	76%	0.764	S	S	*	*			trans	-69.9	77.9	167	-102.8	80.3	0	0	0	107	Q24 C28	Q24-L26 VanDerWaalsContact C-N 3.32Å; Q24-L26 PolarHBondContact O-N 3.12Å; L26-C28 PolarHBondContact O-N 2.94Å
27	A	32.6	Very low	37.5	Very low	71 Å²	71	132.6 Å²	132.6	59%	0.587	76%	0.755	S	S	*	*			trans	-54.6	136	156.9	0	0	0	0	0	107.5	S25 Q29	S25-A27 PolarHBondContact O-N 3.49Å; A27-Q29 VanDerWaalsContact C-N 3.27Å; A27-Q29 PolarHBondContact O-N 3.35Å
28	C	33.6	Very low	38.8	Very low	132 Å²	132	130 Å²	130	89%	0.892	74%	0.735	S	S	*	*			trans	-54.8	92.2	174.3	-63.5	0	0	0	0	109.5	L26	L26-C28 PolarHBondContact O-N 2.94Å
29	Q	35.2	Very low	40	Very low	160 Å²	160	130.6 Å²	130.6	75%	0.748	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-64.5	122.9	173.8	-158.6	98.3	-49.7	0	0	105.8	A27	A27-Q29 VanDerWaalsContact C-N 3.27Å; A27-Q29 PolarHBondContact O-N 3.35Å
30	P	38.6	Very low	41.1	Very low	82 Å²	82	126.1 Å²	126.1	53%	0.532	70%	0.703	S	S	.	*	P	Polyproline II helix	trans	-57.2	149.8	172.8	25.8	-33	0	0	0	108.4	N32	P30-N32 PolarHBondContact O-N 3.27Å
31	P	44.9	Very low	42.9	Very low	107 Å²	107	126.6 Å²	126.6	70%	0.695	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-52.4	123.2	177.7	22.4	-32.2	0	0	0	108.3	H33	P31-H33 PolarHBondContact O-N 2.85Å
32	N	40.4	Very low	44.4	Very low	156 Å²	156	126.7 Å²	126.7	83%	0.834	68%	0.68	S	S	*	*			trans	-58.4	94.1	170.8	-112	-31.1	0	0	0	106.6	P30 S34	P30-N32 PolarHBondContact O-N 3.27Å; N32-S34 PolarHBondContact O-N 3.27Å
33	H	46.8	Very low	46	Very low	175 Å²	175	119.9 Å²	119.9	81%	0.81	66%	0.661	S	S	*	*			trans	-69	89.1	169.4	-101.8	-75	0	0	0	106.6	P31	P31-H33 PolarHBondContact O-N 2.85Å
34	S	40.8	Very low	47.5	Very low	92 Å²	92	114.9 Å²	114.9	64%	0.643	64%	0.639	S	S	*	*			trans	-54.1	130.9	164.7	-159.1	0	0	0	0	107.1	N32 T36	N32-S34 PolarHBondContact O-N 3.27Å; S34-T36 VanDerWaalsContact C-N 3.34Å; S34-T36 PolarHBondContact O-N 3.11Å
35	P	46.7	Very low	49	Very low	112 Å²	112	112 Å²	112	73%	0.727	63%	0.628	S	S	*	*			trans	-64.7	103.4	176.5	27.5	-30.9	0	0	0	105.9	I37	P35-I37 PolarHBondContact O-N 3.23Å
36	T	49.9	Very low	50.5	Low	128 Å²	128	109.9 Å²	109.9	79%	0.785	61%	0.614	S	S	*	*			trans	-56.6	99.3	162.7	42.8	0	0	0	0	105.5	S34 P38	S34-T36 VanDerWaalsContact C-N 3.34Å; S34-T36 PolarHBondContact O-N 3.11Å; T36-P38 WeakPolarHBondContact O-CA 3.36Å
37	I	56.1	Low	51.9	Low	116 Å²	116	106.3 Å²	106.3	60%	0.595	60%	0.595	S	S	*	*			trans	-38.9	116.2	165.8	-63.3	168.6	0	0	0	104.9	P35 I39 L41	P35-I37 PolarHBondContact O-N 3.23Å; I37-I39 PolarHBondContact O-N 3.22Å; I37-L41 HydrophobicContact CG2-CD2 4.09Å
38	P	54.3	Low	53.2	Low	48 Å²	48	107 Å²	107	31%	0.312	60%	0.6	S	S	.	*			trans	-65.2	135.3	-153.9	24.5	-30	0	0	0	106.3	T36 V40 L41 R42	T36-P38 WeakPolarHBondContact O-CA 3.36Å; P38-V40 HydrophobicContact CB-CB 4.28Å; P38-V40 CarbonylContact O-C 3.55Å; P38-V40 PolarHBondContact O-N 3.21Å; P38-L41 HydrophobicContact CG-CB 3.76Å; P38-L41 PolarHBondContact O-N 3.27Å; P38-R42 PolarHBondContact O-N 2.94Å
39	I	61.5	Low	54.4	Low	137 Å²	137	110.5 Å²	110.5	70%	0.703	60%	0.595	S	S	*	*	H	α-helix	trans	-46.4	-28	168.2	-67.6	165.7	0	0	0	109.6	I37 R42 L43	I37-I39 PolarHBondContact O-N 3.22Å; I39-R42 CarbonylContact O-C 3.56Å; I39-R42 PolarHBondContact O-N 3.06Å; I39-L43 WeakPolarHBondContact O-CB 3.44Å; I39-L43 PolarHBondContact O-N 3.16Å
40	V	60.5	Low	55.4	Low	29 Å²	29	111 Å²	111	18%	0.176	60%	0.595	C	S	.	*	H	α-helix	trans	-69.6	-31.4	172.4	175.1	0	0	0	0	115.5	P38 R42 L43 L44 V74	P38-V40 HydrophobicContact CB-CB 4.28Å; P38-V40 CarbonylContact O-C 3.55Å; P38-V40 PolarHBondContact O-N 3.21Å; V40-R42 VanDerWaalsContact C-N 3.35Å; V40-L43 PolarHBondContact O-N 3.2Å; V40-L44 HydrophobicContact CG1-CD1 3.77Å; V40-L44 HydrophobicContact CG1-CG 4.02Å; V40-L44 WeakPolarHBondContact O-CB 3.5Å; V40-L44 WeakPolarHBondContact O-CD1 3.45Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.09Å; V40-V74 HydrophobicContact CG2-CG1 4.45Å
41	L	65.1	Low	56.3	Low	86 Å²	86	118.3 Å²	118.3	45%	0.45	61%	0.612	S	S	.	*	H	α-helix	trans	-68.5	-38.1	169.9	-173.1	66.7	0	0	0	110.4	I37 P38 L45	I37-L41 HydrophobicContact CG2-CD2 4.09Å; P38-L41 HydrophobicContact CG-CB 3.76Å; P38-L41 PolarHBondContact O-N 3.27Å; L41-L45 HydrophobicContact CG-CD1 4.19Å; L41-L45 VanDerWaalsContact O-CB 3.29Å; L41-L45 WeakPolarHBondContact O-CB 3.4Å; L41-L45 WeakPolarHBondContact O-CD1 3.5Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 3.49Å
42	R	64.7	Low	56.7	Low	184 Å²	184	117.5 Å²	117.5	69%	0.694	61%	0.607	S	S	*	*	H	α-helix	trans	-67.7	-36.5	171.8	-72	-170.4	174.7	-176.8	-0.3	112.5	P38 I39 V40 S46	P38-R42 PolarHBondContact O-N 2.94Å; I39-R42 CarbonylContact O-C 3.56Å; I39-R42 PolarHBondContact O-N 3.06Å; V40-R42 VanDerWaalsContact C-N 3.35Å; R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 3.24Å; R42-S46 PolarHBondContact O-OG 3Å
43	L	63.8	Low	57.4	Low	89 Å²	89	114.3 Å²	114.3	47%	0.466	60%	0.602	S	S	.	*	H	α-helix	trans	-69	-47.3	175.4	-131.9	82.2	0	0	0	111	I39 V40 L45 S46 I47	I39-L43 WeakPolarHBondContact O-CB 3.44Å; I39-L43 PolarHBondContact O-N 3.16Å; V40-L43 PolarHBondContact O-N 3.2Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.04Å; L43-S46 CarbonylContact O-C 3.49Å; L43-S46 WeakPolarHBondContact O-CA 3.27Å; L43-S46 WeakPolarHBondContact O-CB 3.29Å; L43-S46 PolarHBondContact O-N 2.95Å; L43-I47 WeakPolarHBondContact O-CD1 3.32Å; L43-I47 WeakPolarHBondContact O-CG1 3.26Å; L43-I47 PolarHBondContact O-N 3.44Å
44	L	63.2	Low	57.9	Low	84 Å²	84	112.8 Å²	112.8	44%	0.44	61%	0.605	S	S	.	*	H	α-helix	trans	-62.1	-39.2	177.2	-72.4	170.4	0	0	0	111.7	V40 S46 I47 A48	V40-L44 HydrophobicContact CG1-CD1 3.77Å; V40-L44 HydrophobicContact CG1-CG 4.02Å; V40-L44 WeakPolarHBondContact O-CB 3.5Å; V40-L44 WeakPolarHBondContact O-CD1 3.45Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.09Å; L44-S46 VanDerWaalsContact C-N 3.3Å; L44-S46 PolarHBondContact O-N 3.31Å; L44-I47 PolarHBondContact O-N 2.88Å; L44-A48 VanDerWaalsContact O-CB 3.24Å; L44-A48 WeakPolarHBondContact O-CB 3.3Å; L44-A48 PolarHBondContact O-N 3.09Å
45	L	65.3	Low	58.7	Low	92 Å²	92	111.8 Å²	111.8	48%	0.482	60%	0.598	S	S	.	*	H	α-helix	trans	-67.7	-28.2	171.9	-73.6	167.4	0	0	0	112.8	L41 L43 R49	L41-L45 HydrophobicContact CG-CD1 4.19Å; L41-L45 VanDerWaalsContact O-CB 3.29Å; L41-L45 WeakPolarHBondContact O-CB 3.4Å; L41-L45 WeakPolarHBondContact O-CD1 3.5Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 3.49Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.04Å; L45-R49 VanDerWaalsContact O-CG 3.26Å; L45-R49 WeakPolarHBondContact O-CG 3.35Å; L45-R49 PolarHBondContact O-N 3.11Å
46	S	62.9	Low	59.4	Low	73 Å²	73	116.7 Å²	116.7	51%	0.51	60%	0.602	S	S	.	*	H	α-helix	trans	-77.7	-35.7	175.2	-59.6	0	0	0	0	112.1	R42 L43 L44 R49 F50	R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 3.24Å; R42-S46 PolarHBondContact O-OG 3Å; L43-S46 CarbonylContact O-C 3.49Å; L43-S46 WeakPolarHBondContact O-CA 3.27Å; L43-S46 WeakPolarHBondContact O-CB 3.29Å; L43-S46 PolarHBondContact O-N 2.95Å; L44-S46 VanDerWaalsContact C-N 3.3Å; L44-S46 PolarHBondContact O-N 3.31Å; S46-R49 PolarHBondContact O-N 2.92Å; S46-F50 PolarHBondContact O-N 3.3Å
47	I	62.6	Low	59.8	Low	79 Å²	79	118.2 Å²	118.2	41%	0.405	61%	0.605	S	S	.	*	H	α-helix	trans	-73.4	-37.1	175.6	-55.2	154.9	0	0	0	110.2	L43 L44 R49 F50	L43-I47 WeakPolarHBondContact O-CD1 3.32Å; L43-I47 WeakPolarHBondContact O-CG1 3.26Å; L43-I47 PolarHBondContact O-N 3.44Å; L44-I47 PolarHBondContact O-N 2.88Å; I47-R49 PolarHBondContact O-N 3.39Å; I47-F50 WeakPolarHBondContact O-CB 3.32Å; I47-F50 PolarHBondContact O-N 3.09Å; I47-F50 VanDerWaalsContact O-N 3.13Å
48	A	60.7	Low	60.1	Low	86 Å²	86	115.6 Å²	115.6	71%	0.711	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-17.3	174.4	0	0	0	0	0	113.7	L44	L44-A48 VanDerWaalsContact O-CB 3.24Å; L44-A48 WeakPolarHBondContact O-CB 3.3Å; L44-A48 PolarHBondContact O-N 3.09Å
49	R	58.9	Low	60.4	Low	206 Å²	206	118 Å²	118	78%	0.777	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-8.9	172.3	-75.4	179.2	-170.2	-169.6	4	113.5	L45 S46 I47 R51	L45-R49 VanDerWaalsContact O-CG 3.26Å; L45-R49 WeakPolarHBondContact O-CG 3.35Å; L45-R49 PolarHBondContact O-N 3.11Å; S46-R49 PolarHBondContact O-N 2.92Å; I47-R49 PolarHBondContact O-N 3.39Å; R49-R51 PolarHBondContact O-N 2.92Å
50	F	56.4	Low	60.4	Low	169 Å²	169	115.8 Å²	115.8	74%	0.741	61%	0.605	S	S	*	*			trans	-74.2	92.4	170.1	-116.8	-96.8	0	0	0	108.2	S46 I47 P52	S46-F50 PolarHBondContact O-N 3.3Å; I47-F50 WeakPolarHBondContact O-CB 3.32Å; I47-F50 PolarHBondContact O-N 3.09Å; I47-F50 VanDerWaalsContact O-N 3.13Å; F50-P52 WeakPolarHBondContact O-CD 3.24Å
51	R	56.1	Low	60.7	Low	236 Å²	236	121.2 Å²	121.2	89%	0.891	63%	0.632	S	S	*	*			trans	-66.4	111.4	164	-76.7	-174.7	175.1	-173.4	-1.1	107	R49 A53	R49-R51 PolarHBondContact O-N 2.92Å; R51-A53 PolarHBondContact O-N 3.47Å
52	P	53.4	Low	61.2	Low	91 Å²	91	120.7 Å²	120.7	59%	0.591	63%	0.634	S	S	*	*			trans	-71.2	110.4	174.3	28.7	-27.7	0	0	0	107.2	F50 T54 S55	F50-P52 WeakPolarHBondContact O-CD 3.24Å; P52-T54 PolarHBondContact O-N 3.36Å; P52-T54 VanDerWaalsContact O-N 3.09Å; P52-S55 WeakPolarHBondContact CB-OG 3.31Å
53	A	56.5	Low	61.6	Low	89 Å²	89	115.8 Å²	115.8	74%	0.736	63%	0.625	S	S	*	*	S	Bend	trans	-63.6	107.7	158.7	0	0	0	0	0	106.3	R51	R51-A53 PolarHBondContact O-N 3.47Å
54	T	56.6	Low	62.1	Low	143 Å²	143	114.4 Å²	114.4	88%	0.877	62%	0.622	S	S	*	*	S	Bend	trans	55.4	82.2	169.9	62.9	0	0	0	0	115.6	P52	P52-T54 PolarHBondContact O-N 3.36Å; P52-T54 VanDerWaalsContact O-N 3.09Å
55	S	57	Low	63	Low	71 Å²	71	115.9 Å²	115.9	50%	0.497	63%	0.63	S	S	.	*			trans	-114.7	125.1	166.6	-54.6	0	0	0	0	109.4	P52	P52-S55 WeakPolarHBondContact CB-OG 3.31Å
56	R	62.1	Low	63.9	Low	214 Å²	214	117.3 Å²	117.3	81%	0.808	64%	0.638	S	S	*	*			trans	-61	140.4	-179.8	-67.9	-166.7	178.4	-146.8	2.2	109	G58 D59	R56-G58 PolarHBondContact O-N 2.93Å; R56-D59 PolarHBondContact O-N 3.38Å
57	L	57.8	Low	64.9	Low	161 Å²	161	117.7 Å²	117.7	84%	0.843	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-16.1	-176.1	-152	73	0	0	0	114.1	I60	L57-I60 HydrophobicContact CD1-CD1 4.3Å
58	G	63.2	Low	65.9	Low	60 Å²	60	118.7 Å²	118.7	62%	0.619	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-20.9	177.7	0	0	0	0	0	116.1	R56	R56-G58 PolarHBondContact O-N 2.93Å
59	D	60.8	Low	67.1	Low	99 Å²	99	119 Å²	119	53%	0.529	63%	0.632	S	S	.	*	S	Bend	trans	-91.4	-5.5	-174.5	-60.1	-42.4	0	0	0	113.5	R56 P62 T63	R56-D59 PolarHBondContact O-N 3.38Å; D59-P62 WeakPolarHBondContact O-CD 2.78Å; D59-T63 WeakPolarHBondContact O-CG2 3.09Å; D59-T63 PolarHBondContact O-OG1 3.46Å
60	I	61.4	Low	68.2	Low	90 Å²	90	114.4 Å²	114.4	46%	0.462	62%	0.618	S	S	.	*	H	α-helix	trans	-80.3	-30.8	-175.5	-54.9	174.6	0	0	0	111.4	L57 T63 S64	L57-I60 HydrophobicContact CD1-CD1 4.3Å; I60-T63 WeakPolarHBondContact CA-OG1 3.48Å; I60-T63 PolarHBondContact O-OG1 3.01Å; I60-T63 VanDerWaalsContact O-OG1 3.09Å; I60-S64 VanDerWaalsContact O-CB 3.22Å; I60-S64 WeakPolarHBondContact O-CB 3.41Å; I60-S64 PolarHBondContact O-N 2.86Å
61	L	65.4	Low	69.3	Low	144 Å²	144	109.2 Å²	109.2	75%	0.754	60%	0.602	S	S	*	*	H	α-helix	trans	-67.1	-48.9	-179.1	-153.1	74.5	0	0	0	113.5	L65	L61-L65 WeakPolarHBondContact O-CB 3.37Å; L61-L65 PolarHBondContact O-N 2.76Å; L61-L65 VanDerWaalsContact O-N 3.11Å
62	P	76.1	Confident	70.3	Confident	75 Å²	75	100.9 Å²	100.9	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-70	-33.5	179.7	26.9	-34.9	0	0	0	112.9	D59 L66	D59-P62 WeakPolarHBondContact O-CD 2.78Å; P62-L66 WeakPolarHBondContact O-CB 3.02Å; P62-L66 PolarHBondContact O-N 3.27Å
63	T	72.8	Confident	71.1	Confident	80 Å²	80	103.1 Å²	103.1	49%	0.491	58%	0.58	S	S	.	*	H	α-helix	trans	-71.4	-40.8	178.6	50.1	0	0	0	0	111.9	D59 I60 L66 L67	D59-T63 WeakPolarHBondContact O-CG2 3.09Å; D59-T63 PolarHBondContact O-OG1 3.46Å; I60-T63 WeakPolarHBondContact CA-OG1 3.48Å; I60-T63 PolarHBondContact O-OG1 3.01Å; I60-T63 VanDerWaalsContact O-OG1 3.09Å; T63-L66 PolarHBondContact O-N 3.29Å; T63-L67 WeakPolarHBondContact O-CG 3.46Å; T63-L67 PolarHBondContact O-N 2.76Å
64	S	75.8	Confident	71.8	Confident	60 Å²	60	100.1 Å²	100.1	42%	0.42	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-43.9	173.1	-173.1	0	0	0	0	112	I60 L66 L67 I68	I60-S64 VanDerWaalsContact O-CB 3.22Å; I60-S64 WeakPolarHBondContact O-CB 3.41Å; I60-S64 PolarHBondContact O-N 2.86Å; S64-L66 PolarHBondContact O-N 2.81Å; S64-L67 PolarHBondContact O-N 2.84Å; S64-I68 VanDerWaalsContact O-CG1 3.31Å; S64-I68 WeakPolarHBondContact O-CG1 3.25Å; S64-I68 PolarHBondContact O-N 3.44Å
65	L	82	Confident	72.4	Confident	116 Å²	116	96 Å²	96	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-59.7	-45.8	175.2	-168.9	87.9	0	0	0	111.7	L61 L67 I68 V69	L61-L65 WeakPolarHBondContact O-CB 3.37Å; L61-L65 PolarHBondContact O-N 2.76Å; L61-L65 VanDerWaalsContact O-N 3.11Å; L65-L67 PolarHBondContact O-N 2.84Å; L65-I68 PolarHBondContact O-N 2.82Å; L65-V69 WeakPolarHBondContact O-CG2 3.32Å; L65-V69 PolarHBondContact O-N 3.04Å
66	L	84.4	Confident	72.6	Confident	122 Å²	122	99.1 Å²	99.1	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-64	-39	179.3	-172.8	140.3	0	0	0	112.1	P62 T63 S64 V69 F70	P62-L66 WeakPolarHBondContact O-CB 3.02Å; P62-L66 PolarHBondContact O-N 3.27Å; T63-L66 PolarHBondContact O-N 3.29Å; S64-L66 PolarHBondContact O-N 2.81Å; L66-V69 PolarHBondContact O-N 3.27Å; L66-F70 VanDerWaalsContact O-CB 3.29Å; L66-F70 WeakPolarHBondContact O-CB 3.04Å; L66-F70 PolarHBondContact O-N 3.45Å
67	L	83.6	Confident	72.6	Confident	80 Å²	80	94 Å²	94	42%	0.419	54%	0.536	S	S	.	.	H	α-helix	trans	-66.4	-39.1	173.8	-73.7	176.8	0	0	0	112.4	T63 S64 L65 F70 C71	T63-L67 WeakPolarHBondContact O-CG 3.46Å; T63-L67 PolarHBondContact O-N 2.76Å; S64-L67 PolarHBondContact O-N 2.84Å; L65-L67 PolarHBondContact O-N 2.84Å; L67-F70 PolarHBondContact O-N 3.35Å; L67-C71 WeakPolarHBondContact O-CB 3.43Å; L67-C71 PolarHBondContact O-N 3.43Å
68	I	83.8	Confident	72.7	Confident	101 Å²	101	92 Å²	92	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-48.1	175.1	-68.2	165.6	0	0	0	110.2	S64 L65 F70 C71 S72	S64-I68 VanDerWaalsContact O-CG1 3.31Å; S64-I68 WeakPolarHBondContact O-CG1 3.25Å; S64-I68 PolarHBondContact O-N 3.44Å; L65-I68 PolarHBondContact O-N 2.82Å; I68-F70 VanDerWaalsContact C-N 3.34Å; I68-F70 PolarHBondContact O-N 2.94Å; I68-C71 PolarHBondContact O-N 2.94Å; I68-S72 WeakPolarHBondContact O-CB 3.33Å; I68-S72 PolarHBondContact O-N 3.49Å; I68-S72 PolarHBondContact O-OG 2.83Å; I68-S72 VanDerWaalsContact O-OG 3.12Å
69	V	84.6	Confident	72.8	Confident	93 Å²	93	91 Å²	91	56%	0.564	51%	0.508	S	S	*	.	H	α-helix	trans	-59.5	-45.2	177.2	172.2	0	0	0	0	111	L65 L66 S72 F73	L65-V69 WeakPolarHBondContact O-CG2 3.32Å; L65-V69 PolarHBondContact O-N 3.04Å; L66-V69 PolarHBondContact O-N 3.27Å; V69-S72 PolarHBondContact O-N 3.4Å; V69-F73 WeakPolarHBondContact O-CB 3.39Å; V69-F73 PolarHBondContact O-N 3.47Å
70	F	82.7	Confident	73.6	Confident	109 Å²	109	89.7 Å²	89.7	48%	0.478	51%	0.511	S	S	.	.	H	α-helix	trans	-63.4	-42.6	176.3	-175.5	-101.3	0	0	0	111.9	L66 L67 I68 F73 V74	L66-F70 VanDerWaalsContact O-CB 3.29Å; L66-F70 WeakPolarHBondContact O-CB 3.04Å; L66-F70 PolarHBondContact O-N 3.45Å; L67-F70 PolarHBondContact O-N 3.35Å; I68-F70 VanDerWaalsContact C-N 3.34Å; I68-F70 PolarHBondContact O-N 2.94Å; F70-F73 PolarHBondContact O-N 3.27Å; F70-V74 HydrophobicContact CD1-CG2 4.06Å; F70-V74 HydrophobicContact CD2-CG2 4.49Å; F70-V74 HydrophobicContact CE1-CG2 3.7Å; F70-V74 HydrophobicContact CE2-CG2 4.16Å; F70-V74 HydrophobicContact CG-CG2 4.44Å; F70-V74 HydrophobicContact CZ-CG2 3.76Å; F70-V74 WeakPolarHBondContact O-CB 3.44Å; F70-V74 VanDerWaalsContact O-CG2 3.26Å; F70-V74 WeakPolarHBondContact O-CG2 3.46Å; F70-V74 PolarHBondContact O-N 3.36Å
71	C	79.8	Confident	74.8	Confident	60 Å²	60	86.9 Å²	86.9	41%	0.405	50%	0.499	S	S	.	.	H	α-helix	trans	-66.2	-40.2	178.4	-153.9	0	0	0	0	111.4	L67 I68 V74 A75	L67-C71 WeakPolarHBondContact O-CB 3.43Å; L67-C71 PolarHBondContact O-N 3.43Å; I68-C71 PolarHBondContact O-N 2.94Å; C71-V74 PolarHBondContact O-N 3.14Å; C71-A75 WeakPolarHBondContact O-CB 3Å; C71-A75 PolarHBondContact O-N 3.34Å
72	S	76.2	Confident	75.8	Confident	61 Å²	61	83.1 Å²	83.1	43%	0.427	48%	0.477	S	S	.	.	H	α-helix	trans	-62.9	-41.2	172	-63.8	0	0	0	0	111.9	I68 V69 N76	I68-S72 WeakPolarHBondContact O-CB 3.33Å; I68-S72 PolarHBondContact O-N 3.49Å; I68-S72 PolarHBondContact O-OG 2.83Å; I68-S72 VanDerWaalsContact O-OG 3.12Å; V69-S72 PolarHBondContact O-N 3.4Å; S72-N76 WeakPolarHBondContact O-CB 3.27Å; S72-N76 PolarHBondContact O-N 2.9Å; S72-N76 PolarHBondContact O-ND2 2.97Å
73	F	71.3	Confident	76.4	Confident	138 Å²	138	80.1 Å²	80.1	61%	0.605	46%	0.457	S	S	*	.	H	α-helix	trans	-62.8	-49.1	175.5	-173	-99.6	0	0	0	111.1	V69 F70 A75 N76 V77	V69-F73 WeakPolarHBondContact O-CB 3.39Å; V69-F73 PolarHBondContact O-N 3.47Å; F70-F73 PolarHBondContact O-N 3.27Å; F73-A75 PolarHBondContact O-N 2.94Å; F73-N76 PolarHBondContact O-N 2.05Å; F73-V77 HydrophobicContact CD1-CG2 4.44Å; F73-V77 HydrophobicContact CE1-CG2 4.25Å; F73-V77 VanDerWaalsContact O-CG2 3.28Å; F73-V77 WeakPolarHBondContact O-CG2 3.26Å; F73-V77 PolarHBondContact O-N 2.77Å; F73-V77 VanDerWaalsContact O-N 3.08Å
74	V	71.7	Confident	77.2	Confident	25 Å²	25	81.8 Å²	81.8	15%	0.152	46%	0.455	C	S	.	.	H	α-helix	trans	-67	-36.2	179.2	176.5	0	0	0	0	112	V40 F70 C71 V77 R78	V40-V74 HydrophobicContact CG2-CG1 4.45Å; F70-V74 HydrophobicContact CD1-CG2 4.06Å; F70-V74 HydrophobicContact CD2-CG2 4.49Å; F70-V74 HydrophobicContact CE1-CG2 3.7Å; F70-V74 HydrophobicContact CE2-CG2 4.16Å; F70-V74 HydrophobicContact CG-CG2 4.44Å; F70-V74 HydrophobicContact CZ-CG2 3.76Å; F70-V74 WeakPolarHBondContact O-CB 3.44Å; F70-V74 VanDerWaalsContact O-CG2 3.26Å; F70-V74 WeakPolarHBondContact O-CG2 3.46Å; F70-V74 PolarHBondContact O-N 3.36Å; C71-V74 PolarHBondContact O-N 3.14Å; V74-V77 PolarHBondContact O-N 3.47Å; V74-R78 VanDerWaalsContact CG1-CZ 3.43Å; V74-R78 VanDerWaalsContact CG1-NH2 3.31Å; V74-R78 WeakPolarHBondContact O-CB 3.21Å; V74-R78 VanDerWaalsContact O-CG 3.26Å; V74-R78 WeakPolarHBondContact O-CG 3.21Å; V74-R78 PolarHBondContact O-N 3.25Å; V74-R78 VanDerWaalsContact O-N 3.16Å
75	A	67.4	Low	78	Confident	58 Å²	58	84.9 Å²	84.9	48%	0.479	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-39.2	175.3	0	0	0	0	0	111.7	C71 F73 V77 R78	C71-A75 WeakPolarHBondContact O-CB 3Å; C71-A75 PolarHBondContact O-N 3.34Å; F73-A75 PolarHBondContact O-N 2.94Å; A75-V77 VanDerWaalsContact C-N 3.29Å; A75-V77 PolarHBondContact O-N 2.87Å; A75-R78 PolarHBondContact O-N 2.87Å
76	N	62.9	Low	78.6	Confident	135 Å²	135	79.5 Å²	79.5	72%	0.722	43%	0.43	S	S	*	.	H	α-helix	trans	-67.1	-29.3	174	-80.7	-64	0	0	0	112.8	S72 F73 R78	S72-N76 WeakPolarHBondContact O-CB 3.27Å; S72-N76 PolarHBondContact O-N 2.9Å; S72-N76 PolarHBondContact O-ND2 2.97Å; F73-N76 PolarHBondContact O-N 2.05Å; N76-R78 VanDerWaalsContact C-N 3.29Å
77	V	61.6	Low	79.1	Confident	106 Å²	106	74.5 Å²	74.5	64%	0.642	41%	0.406	S	S	*	.	H	α-helix	trans	-77.3	-15.6	174.8	175.5	0	0	0	0	112.3	F73 V74 A75	F73-V77 HydrophobicContact CD1-CG2 4.44Å; F73-V77 HydrophobicContact CE1-CG2 4.25Å; F73-V77 VanDerWaalsContact O-CG2 3.28Å; F73-V77 WeakPolarHBondContact O-CG2 3.26Å; F73-V77 PolarHBondContact O-N 2.77Å; F73-V77 VanDerWaalsContact O-N 3.08Å; V74-V77 PolarHBondContact O-N 3.47Å; A75-V77 VanDerWaalsContact C-N 3.29Å; A75-V77 PolarHBondContact O-N 2.87Å
78	R	59.1	Low	79.6	Confident	119 Å²	119	73.5 Å²	73.5	45%	0.449	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.2	-172.1	-86.8	-179.5	-176.3	154.9	10.6	116.7	V74 A75 N76 A80	V74-R78 VanDerWaalsContact CG1-CZ 3.43Å; V74-R78 VanDerWaalsContact CG1-NH2 3.31Å; V74-R78 WeakPolarHBondContact O-CB 3.21Å; V74-R78 VanDerWaalsContact O-CG 3.26Å; V74-R78 WeakPolarHBondContact O-CG 3.21Å; V74-R78 PolarHBondContact O-N 3.25Å; V74-R78 VanDerWaalsContact O-N 3.16Å; A75-R78 PolarHBondContact O-N 2.87Å; N76-R78 VanDerWaalsContact C-N 3.29Å; R78-A80 PolarHBondContact O-N 2.67Å
79	G	66	Low	79.9	Confident	41 Å²	41	72.5 Å²	72.5	42%	0.423	41%	0.405	S	S	.	.	S	Bend	trans	-58.8	114.4	166.1	0	0	0	0	0	107.8	C81 S124	G79-C81 PolarHBondContact O-N 3.04Å; G79-S124 WeakPolarHBondContact O-CB 3.45Å
80	A	77.5	Confident	80.3	Confident	71 Å²	71	69 Å²	69	59%	0.587	38%	0.382	S	S	*	.			trans	-61.1	138.8	174.3	0	0	0	0	0	108.5	R78 E82 S124	R78-A80 PolarHBondContact O-N 2.67Å; A80-E82 PolarHBondContact O-N 3.47Å; A80-S124 WeakPolarHBondContact O-CB 3.42Å; A80-S124 PolarHBondContact O-OG 3.28Å
81	C	86.1	Confident	80.8	Confident	30 Å²	30	67 Å²	67	20%	0.203	38%	0.379	C	S	.	.			trans	-71.5	112.4	170.9	176.9	0	0	0	0	108.3	G79 C125 N128	G79-C81 PolarHBondContact O-N 3.04Å; C81-C125 WeakPolarHBondContact CA-SG 3.17Å; C81-C125 HydrophobicContact CB-CB 4Å; C81-C125 WeakPolarHBondContact CB-SG 3.24Å; C81-C125 VanDerWaalsContact SG-CA 3.58Å; C81-C125 WeakPolarHBondContact SG-CB 3.27Å; C81-C125 CovalentContact SG-SG 2.03Å; C81-C125 PolarHBondContact SG-SG 3Å; C81-N128 HydrophobicContact CB-CB 4.38Å; C81-N128 PolarHBondContact SG-ND2 3.34Å
82	E	86.8	Confident	81.4	Confident	65 Å²	65	71.3 Å²	71.3	30%	0.304	39%	0.387	S	S	.	.			trans	-102.9	39.7	-177.8	-59.9	-169.4	129.8	0	0	112	A80 Y84 R85 T121	A80-E82 PolarHBondContact O-N 3.47Å; E82-Y84 HydrophobicContact CB-CD1 4.42Å; E82-Y84 HydrophobicContact CB-CE1 3.97Å; E82-Y84 HydrophobicContact CG-CE1 4.06Å; E82-Y84 PolarHBondContact O-N 3.1Å; E82-R85 VanDerWaalsContact CD-CZ 3.45Å; E82-R85 PolarHBondContact O-N 3.12Å; E82-R85 IonicContact OE1-CZ 3.59Å; E82-R85 IonicContact OE1-NE 3.68Å; E82-R85 IonicContact OE1-NH1 2.89Å; E82-R85 PolarHBondContact OE1-NH1 3.38Å; E82-R85 IonicContact OE1-NH2 3.57Å; E82-R85 PolarHBondContact OE1-NH2 3.38Å; E82-R85 IonicContact OE2-CZ 2.91Å; E82-R85 IonicContact OE2-NH1 3.61Å; E82-R85 PolarHBondContact OE2-NH1 2.72Å; E82-T121 HydrophobicContact CB-CG2 4.46Å
83	D	87.5	Confident	81.8	Confident	13 Å²	13	70 Å²	70	7%	0.07	37%	0.374	C	S	.	.	H	α-helix	trans	-63.8	-29.4	176.1	67.3	-33.1	0	0	0	112.7	R85 C86 A87 L118 R130 Y131	D83-R85 VanDerWaalsContact C-N 3.27Å; D83-R85 PolarHBondContact O-N 3.11Å; D83-C86 WeakPolarHBondContact O-CB 3.35Å; D83-C86 PolarHBondContact O-N 2.94Å; D83-A87 PolarHBondContact O-N 3.3Å; D83-L118 HydrophobicContact CB-CD2 4.43Å; D83-R130 WeakPolarHBondContact OD2-CG 3.26Å; D83-Y131 HydrophobicContact CB-CD2 4.32Å; D83-Y131 PolarHBondContact OD2-N 2.92Å
84	Y	91.5	Very high	82.6	Confident	115 Å²	115	65.3 Å²	65.3	45%	0.451	36%	0.356	S	S	.	.	H	α-helix	trans	-57.5	-35.8	176.5	75.6	-87.6	0	0	0	113.2	E82 A87 A88	E82-Y84 HydrophobicContact CB-CD1 4.42Å; E82-Y84 HydrophobicContact CB-CE1 3.97Å; E82-Y84 HydrophobicContact CG-CE1 4.06Å; E82-Y84 PolarHBondContact O-N 3.1Å; Y84-A87 PolarHBondContact O-N 3.25Å; Y84-A88 VanDerWaalsContact O-CB 3.3Å; Y84-A88 WeakPolarHBondContact O-CB 3.23Å; Y84-A88 PolarHBondContact O-N 3.49Å
85	R	92.7	Very high	83.2	Confident	124 Å²	124	70.2 Å²	70.2	47%	0.468	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-47.8	178.2	-68.6	-171	176.3	153.6	9.3	110.7	E82 D83 A87 A88 D89	E82-R85 VanDerWaalsContact CD-CZ 3.45Å; E82-R85 PolarHBondContact O-N 3.12Å; E82-R85 IonicContact OE1-CZ 3.59Å; E82-R85 IonicContact OE1-NE 3.68Å; E82-R85 IonicContact OE1-NH1 2.89Å; E82-R85 PolarHBondContact OE1-NH1 3.38Å; E82-R85 IonicContact OE1-NH2 3.57Å; E82-R85 PolarHBondContact OE1-NH2 3.38Å; E82-R85 IonicContact OE2-CZ 2.91Å; E82-R85 IonicContact OE2-NH1 3.61Å; E82-R85 PolarHBondContact OE2-NH1 2.72Å; D83-R85 VanDerWaalsContact C-N 3.27Å; D83-R85 PolarHBondContact O-N 3.11Å; R85-A87 VanDerWaalsContact C-N 3.3Å; R85-A87 PolarHBondContact O-N 3Å; R85-A88 PolarHBondContact O-N 2.78Å; R85-D89 PolarHBondContact O-N 3.39Å
86	C	94.2	Very high	83.8	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.027	38%	0.377	C	S	.	.	H	α-helix	trans	-58.9	-44.2	176.6	-57.8	0	0	0	0	111.2	D83 F90 Y114 C117 L118	D83-C86 WeakPolarHBondContact O-CB 3.35Å; D83-C86 PolarHBondContact O-N 2.94Å; C86-F90 WeakPolarHBondContact O-CB 3.47Å; C86-F90 PolarHBondContact O-N 2.78Å; C86-F90 VanDerWaalsContact O-N 3.08Å; C86-Y114 VanDerWaalsContact C-CE2 3.45Å; C86-Y114 HydrophobicContact CB-CD2 3.87Å; C86-Y114 HydrophobicContact CB-CE2 3.59Å; C86-Y114 WeakPolarHBondContact O-CE2 3.36Å; C86-C117 WeakPolarHBondContact CA-SG 3.47Å; C86-C117 HydrophobicContact CB-CB 3.76Å; C86-C117 WeakPolarHBondContact CB-SG 3.17Å; C86-C117 WeakPolarHBondContact SG-CB 3.42Å; C86-C117 CovalentContact SG-SG 2.04Å; C86-C117 PolarHBondContact SG-SG 3.42Å; C86-L118 HydrophobicContact CB-CD2 4.19Å; C86-L118 HydrophobicContact CB-CG 4.5Å
87	A	94.2	Very high	84.5	Confident	17 Å²	17	66.4 Å²	66.4	14%	0.14	37%	0.37	C	S	.	.	H	α-helix	trans	-66.3	-40.4	178.8	0	0	0	0	0	112.8	D83 Y84 R85 F90 T91 Y114 I134	D83-A87 PolarHBondContact O-N 3.3Å; Y84-A87 PolarHBondContact O-N 3.25Å; R85-A87 VanDerWaalsContact C-N 3.3Å; R85-A87 PolarHBondContact O-N 3Å; A87-F90 PolarHBondContact O-N 3.17Å; A87-T91 WeakPolarHBondContact O-CB 3.04Å; A87-T91 PolarHBondContact O-N 3.41Å; A87-T91 PolarHBondContact O-OG1 2.87Å; A87-Y114 WeakPolarHBondContact CA-OH 3.37Å; A87-Y114 WeakPolarHBondContact CB-OH 3.04Å; A87-I134 HydrophobicContact CB-CD1 4.44Å
88	A	93.6	Very high	85.1	Confident	58 Å²	58	69.7 Å²	69.7	48%	0.479	38%	0.376	S	S	.	.	H	α-helix	trans	-63.1	-44.9	177.6	0	0	0	0	0	111.5	Y84 R85 T91 R92	Y84-A88 VanDerWaalsContact O-CB 3.3Å; Y84-A88 WeakPolarHBondContact O-CB 3.23Å; Y84-A88 PolarHBondContact O-N 3.49Å; R85-A88 PolarHBondContact O-N 2.78Å; A88-T91 PolarHBondContact O-N 2.9Å; A88-R92 WeakPolarHBondContact O-CB 3.33Å; A88-R92 PolarHBondContact O-N 3.45Å
89	D	90.9	Very high	85.9	Confident	80 Å²	80	65 Å²	65	43%	0.428	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-43.2	177	-83.7	-36.5	0	0	0	112.7	R85 R92 I93	R85-D89 PolarHBondContact O-N 3.39Å; D89-R92 PolarHBondContact O-N 3.19Å; D89-R92 IonicContact OD1-NE 3.07Å; D89-R92 IonicContact OD1-NH2 3.79Å; D89-I93 VanDerWaalsContact O-CG1 3.32Å; D89-I93 WeakPolarHBondContact O-CG1 3.48Å; D89-I93 PolarHBondContact O-N 2.88Å; D89-I93 VanDerWaalsContact O-N 3.15Å
90	F	93.2	Very high	86.8	Confident	19 Å²	19	69 Å²	69	8%	0.083	37%	0.371	C	S	.	.	H	α-helix	trans	-59.5	-48.8	176.4	-179.8	-100.2	0	0	0	111.7	C86 A87 I93 L94 Y107 L110 L111 Y114	C86-F90 WeakPolarHBondContact O-CB 3.47Å; C86-F90 PolarHBondContact O-N 2.78Å; C86-F90 VanDerWaalsContact O-N 3.08Å; A87-F90 PolarHBondContact O-N 3.17Å; F90-I93 PolarHBondContact O-N 3.39Å; F90-L94 HydrophobicContact CD1-CD1 3.93Å; F90-L94 HydrophobicContact CE1-CD1 3.38Å; F90-L94 HydrophobicContact CE1-CG 4.36Å; F90-L94 HydrophobicContact CZ-CD1 3.76Å; F90-L94 HydrophobicContact CZ-CG 4.5Å; F90-L94 PolarHBondContact O-N 2.89Å; F90-Y107 HydrophobicContact CZ-CE2 4.25Å; F90-L110 HydrophobicContact CD2-CD1 4.07Å; F90-L110 HydrophobicContact CD2-CD2 4.02Å; F90-L110 HydrophobicContact CD2-CG 3.67Å; F90-L110 HydrophobicContact CE2-CD2 3.91Å; F90-L110 HydrophobicContact CE2-CG 3.7Å; F90-L111 HydrophobicContact CE2-CD2 4Å; F90-L111 HydrophobicContact CZ-CD2 4.08Å; F90-Y114 HydrophobicContact CB-CD1 3.96Å; F90-Y114 HydrophobicContact CB-CD2 4.18Å; F90-Y114 HydrophobicContact CB-CE1 4.06Å; F90-Y114 HydrophobicContact CB-CE2 4.29Å; F90-Y114 HydrophobicContact CB-CG 4.01Å; F90-Y114 AromaticContact CD1-CD1 3.95Å; F90-Y114 HydrophobicContact CD1-CD1 3.95Å; F90-Y114 AromaticContact CD1-CE1 3.8Å; F90-Y114 HydrophobicContact CD1-CE1 3.8Å; F90-Y114 AromaticContact CD2-CD1 3.39Å; F90-Y114 HydrophobicContact CD2-CD1 3.39Å; F90-Y114 HydrophobicContact CD2-CE1 4.1Å; F90-Y114 AromaticContact CD2-CG 3.73Å; F90-Y114 HydrophobicContact CD2-CG 3.73Å; F90-Y114 HydrophobicContact CE1-CD1 4.26Å; F90-Y114 HydrophobicContact CE1-CE1 4.22Å; F90-Y114 AromaticContact CE2-CD1 3.75Å; F90-Y114 HydrophobicContact CE2-CD1 3.75Å; F90-Y114 HydrophobicContact CE2-CE1 4.5Å; F90-Y114 HydrophobicContact CE2-CG 4.39Å; F90-Y114 AromaticContact CG-CD1 3.49Å; F90-Y114 HydrophobicContact CG-CD1 3.49Å; F90-Y114 VanDerWaalsContact CG-CD1 3.49Å; F90-Y114 AromaticContact CG-CE1 3.72Å; F90-Y114 HydrophobicContact CG-CE1 3.72Å; F90-Y114 AromaticContact CG-CG 3.95Å; F90-Y114 HydrophobicContact CG-CG 3.95Å; F90-Y114 HydrophobicContact CZ-CD1 4.17Å
91	T	93.3	Very high	87.4	Confident	67 Å²	67	68.3 Å²	68.3	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-44.9	-179.2	-50.4	0	0	0	0	111	A87 A88 I93 L94 D95	A87-T91 WeakPolarHBondContact O-CB 3.04Å; A87-T91 PolarHBondContact O-N 3.41Å; A87-T91 PolarHBondContact O-OG1 2.87Å; A88-T91 PolarHBondContact O-N 2.9Å; T91-I93 PolarHBondContact O-N 3.04Å; T91-L94 PolarHBondContact O-N 3.12Å; T91-L94 VanDerWaalsContact O-N 3.09Å; T91-D95 WeakPolarHBondContact O-CB 3.36Å; T91-D95 VanDerWaalsContact O-CG 3.28Å; T91-D95 PolarHBondContact O-N 3.47Å
92	R	92	Very high	87.4	Confident	151 Å²	151	68.8 Å²	68.8	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-55.8	-37.8	176.4	-176.8	-174.9	66.2	78.8	0.9	112.8	A88 D89 S96	A88-R92 WeakPolarHBondContact O-CB 3.33Å; A88-R92 PolarHBondContact O-N 3.45Å; D89-R92 PolarHBondContact O-N 3.19Å; D89-R92 IonicContact OD1-NE 3.07Å; D89-R92 IonicContact OD1-NH2 3.79Å; R92-S96 PolarHBondContact O-N 3.49Å
93	I	84.5	Confident	87.5	Confident	33 Å²	33	68.6 Å²	68.6	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-73.3	-39.3	178.9	-66.1	166.1	0	0	0	110.9	D89 F90 T91 S96 V99 L110	D89-I93 VanDerWaalsContact O-CG1 3.32Å; D89-I93 WeakPolarHBondContact O-CG1 3.48Å; D89-I93 PolarHBondContact O-N 2.88Å; D89-I93 VanDerWaalsContact O-N 3.15Å; F90-I93 PolarHBondContact O-N 3.39Å; T91-I93 PolarHBondContact O-N 3.04Å; I93-S96 WeakPolarHBondContact O-CB 3.34Å; I93-S96 PolarHBondContact O-N 2.74Å; I93-S96 PolarHBondContact O-OG 3.47Å; I93-V99 HydrophobicContact CG2-CB 4.42Å; I93-V99 HydrophobicContact CG2-CG2 3.8Å; I93-L110 HydrophobicContact CB-CD1 3.98Å; I93-L110 HydrophobicContact CB-CD2 4.18Å; I93-L110 HydrophobicContact CD1-CD1 3.54Å; I93-L110 HydrophobicContact CG1-CD1 4.36Å; I93-L110 HydrophobicContact CG2-CD1 3.85Å; I93-L110 HydrophobicContact CG2-CD2 3.77Å; I93-L110 HydrophobicContact CG2-CG 4.42Å
94	L	87.4	Confident	87.4	Confident	40 Å²	40	69.9 Å²	69.9	21%	0.209	38%	0.376	C	S	.	.	H	α-helix	trans	-64.1	-45.2	174.4	-69.6	178.2	0	0	0	111.7	F90 T91 S96 G97 V99 V101 Y107 L110	F90-L94 HydrophobicContact CD1-CD1 3.93Å; F90-L94 HydrophobicContact CE1-CD1 3.38Å; F90-L94 HydrophobicContact CE1-CG 4.36Å; F90-L94 HydrophobicContact CZ-CD1 3.76Å; F90-L94 HydrophobicContact CZ-CG 4.5Å; F90-L94 PolarHBondContact O-N 2.89Å; T91-L94 PolarHBondContact O-N 3.12Å; T91-L94 VanDerWaalsContact O-N 3.09Å; L94-S96 PolarHBondContact O-N 3.1Å; L94-G97 PolarHBondContact O-N 3.03Å; L94-V99 HydrophobicContact CD2-CB 4.42Å; L94-V99 HydrophobicContact CD2-CG1 4.28Å; L94-V101 HydrophobicContact CD2-CG2 4.01Å; L94-Y107 HydrophobicContact CD2-CD2 4.23Å; L94-Y107 HydrophobicContact CD2-CE2 4.09Å; L94-L110 HydrophobicContact CD2-CD2 3.75Å; L94-L110 HydrophobicContact CG-CD2 4.01Å
95	D	85	Confident	87.1	Confident	129 Å²	129	66.7 Å²	66.7	69%	0.69	37%	0.367	S	S	*	.	H	α-helix	trans	-66	-21.5	179.6	-66.9	-15.5	0	0	0	112.7	T91 G97	T91-D95 WeakPolarHBondContact O-CB 3.36Å; T91-D95 VanDerWaalsContact O-CG 3.28Å; T91-D95 PolarHBondContact O-N 3.47Å; D95-G97 PolarHBondContact O-N 3.01Å
96	S	80.3	Confident	86.8	Confident	57 Å²	57	64.1 Å²	64.1	40%	0.399	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.6	174.5	79.5	0	0	0	0	113.7	R92 I93 L94 K98	R92-S96 PolarHBondContact O-N 3.49Å; I93-S96 WeakPolarHBondContact O-CB 3.34Å; I93-S96 PolarHBondContact O-N 2.74Å; I93-S96 PolarHBondContact O-OG 3.47Å; L94-S96 PolarHBondContact O-N 3.1Å; S96-K98 PolarHBondContact O-N 3.21Å; S96-K98 VanDerWaalsContact O-N 3.1Å; S96-K98 WeakPolarHBondContact OG-CB 3.41Å; S96-K98 WeakPolarHBondContact OG-CG 3.38Å; S96-K98 PolarHBondContact OG-N 2.89Å
97	G	77.4	Confident	86.8	Confident	55 Å²	55	64 Å²	64	57%	0.567	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-1.1	-177.4	0	0	0	0	0	114.4	L94 D95 V99	L94-G97 PolarHBondContact O-N 3.03Å; D95-G97 PolarHBondContact O-N 3.01Å; G97-V99 VanDerWaalsContact C-N 3.31Å; G97-V99 PolarHBondContact O-N 3.33Å
98	K	72.9	Confident	86.8	Confident	175 Å²	175	63.2 Å²	63.2	76%	0.761	36%	0.358	S	S	*	.	S	Bend	trans	-74	-22.7	-179.6	-64.8	-179.9	-178.6	-178.8	0	113.3	S96	S96-K98 PolarHBondContact O-N 3.21Å; S96-K98 VanDerWaalsContact O-N 3.1Å; S96-K98 WeakPolarHBondContact OG-CB 3.41Å; S96-K98 WeakPolarHBondContact OG-CG 3.38Å; S96-K98 PolarHBondContact OG-N 2.89Å
99	V	77.4	Confident	86.6	Confident	21 Å²	21	64.1 Å²	64.1	13%	0.127	35%	0.352	C	S	.	.	S	Bend	trans	-126.5	117.5	-177.8	-179.2	0	0	0	0	108.5	I93 L94 G97 P106 Y107 L110	I93-V99 HydrophobicContact CG2-CB 4.42Å; I93-V99 HydrophobicContact CG2-CG2 3.8Å; L94-V99 HydrophobicContact CD2-CB 4.42Å; L94-V99 HydrophobicContact CD2-CG1 4.28Å; G97-V99 VanDerWaalsContact C-N 3.31Å; G97-V99 PolarHBondContact O-N 3.33Å; V99-P106 HydrophobicContact CG1-CB 4.31Å; V99-P106 HydrophobicContact CG2-CB 4.28Å; V99-Y107 HydrophobicContact CG1-CD2 3.93Å; V99-Y107 HydrophobicContact CG1-CG 4.45Å; V99-L110 HydrophobicContact CB-CD2 4.26Å; V99-L110 HydrophobicContact CG1-CB 4.5Å; V99-L110 HydrophobicContact CG1-CD2 3.96Å; V99-L110 HydrophobicContact CG2-CD2 4.43Å
100	L	84.7	Confident	86.7	Confident	124 Å²	124	60.7 Å²	60.7	65%	0.649	33%	0.333	S	S	*	.			trans	-91.4	136.7	175.4	-62	111	0	0	0	110.1	S102 N104	L100-S102 PolarHBondContact O-N 2.9Å; L100-N104 PolarHBondContact O-ND2 3.38Å
101	V	90.8	Very high	86.9	Confident	57 Å²	57	59.8 Å²	59.8	35%	0.345	33%	0.329	S	S	.	.	S	Bend	trans	-70.2	100.5	173.9	-178.6	0	0	0	0	108.9	L94 Y107 Y145	L94-V101 HydrophobicContact CD2-CG2 4.01Å; V101-Y107 HydrophobicContact CB-CE2 4.35Å; V101-Y107 HydrophobicContact CG1-CE1 4.15Å; V101-Y107 HydrophobicContact CG1-CE2 4.27Å; V101-Y107 HydrophobicContact CG2-CD2 4.41Å; V101-Y107 HydrophobicContact CG2-CE2 3.9Å; V101-Y145 HydrophobicContact CG1-CE2 4.2Å; V101-Y145 WeakPolarHBondContact CG1-OH 3.02Å
102	S	85.1	Confident	86.9	Confident	40 Å²	40	58.9 Å²	58.9	28%	0.28	32%	0.32	S	S	.	.	S	Bend	trans	-166	178.4	177.2	-179.4	0	0	0	0	109.5	L100 N104 Y107 Y145	L100-S102 PolarHBondContact O-N 2.9Å; S102-N104 WeakPolarHBondContact CB-ND2 3.46Å; S102-N104 PolarHBondContact O-N 2.89Å; S102-N104 PolarHBondContact O-ND2 3.48Å; S102-Y107 WeakPolarHBondContact O-CD1 3.31Å; S102-Y145 VanDerWaalsContact C-CD1 3.43Å
103	S	88.8	Confident	86.9	Confident	62 Å²	62	57.5 Å²	57.5	43%	0.434	32%	0.32	S	S	.	.	S	Bend	trans	-74.4	62.8	174.7	179.8	0	0	0	0	111	Y145	S103-Y145 PolarHBondContact OG-O 3.38Å
104	N	85.8	Confident	87.4	Confident	39 Å²	39	56.5 Å²	56.5	21%	0.209	32%	0.315	C	S	.	.	S	Bend	trans	-127.8	159.5	-179	68.2	72	0	0	0	112.3	L100 S102 P106 Y107 C108	L100-N104 PolarHBondContact O-ND2 3.38Å; S102-N104 WeakPolarHBondContact CB-ND2 3.46Å; S102-N104 PolarHBondContact O-N 2.89Å; S102-N104 PolarHBondContact O-ND2 3.48Å; N104-P106 VanDerWaalsContact OD1-CD 3.23Å; N104-P106 WeakPolarHBondContact OD1-CD 3.39Å; N104-Y107 PolarHBondContact O-N 3.19Å; N104-Y107 WeakPolarHBondContact OD1-CB 3.31Å; N104-Y107 PolarHBondContact OD1-N 3.31Å; N104-C108 PolarHBondContact O-N 3.01Å; N104-C108 VanDerWaalsContact O-N 3.14Å; N104-C108 PolarHBondContact O-SG 3.14Å; N104-C108 VanDerWaalsContact O-SG 3.36Å
105	L	85.1	Confident	87.8	Confident	48 Å²	48	55.7 Å²	55.7	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-65.7	-45	-174.7	-174.8	69.8	0	0	0	113.6	Y107 C108 F109 L151 H154	L105-Y107 VanDerWaalsContact C-N 3.32Å; L105-Y107 PolarHBondContact O-N 2.98Å; L105-C108 PolarHBondContact O-N 2.89Å; L105-F109 HydrophobicContact CD1-CD2 3.92Å; L105-F109 HydrophobicContact CD1-CE2 3.51Å; L105-F109 HydrophobicContact CD1-CZ 4.21Å; L105-F109 HydrophobicContact CD2-CD2 4.48Å; L105-F109 HydrophobicContact CD2-CE2 3.88Å; L105-F109 HydrophobicContact CG-CD2 3.71Å; L105-F109 HydrophobicContact CG-CE2 3.48Å; L105-F109 VanDerWaalsContact CG-CE2 3.48Å; L105-F109 WeakPolarHBondContact O-CD2 3.44Å; L105-F109 PolarHBondContact O-N 3.28Å; L105-L151 HydrophobicContact CD1-CD2 4.08Å; L105-H154 HydrophobicContact CD1-CB 3.74Å; L105-H154 HydrophobicContact CD2-CB 4.13Å; L105-H154 WeakPolarHBondContact CD2-CD2 3.35Å
106	P	86.5	Confident	88.3	Confident	70 Å²	70	52.7 Å²	52.7	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-55.3	-42.3	175	-27.9	34.1	0	0	0	114.1	V99 N104 F109 L110	V99-P106 HydrophobicContact CG1-CB 4.31Å; V99-P106 HydrophobicContact CG2-CB 4.28Å; N104-P106 VanDerWaalsContact OD1-CD 3.23Å; N104-P106 WeakPolarHBondContact OD1-CD 3.39Å; P106-F109 PolarHBondContact O-N 3.45Å; P106-L110 WeakPolarHBondContact O-CB 3.25Å; P106-L110 PolarHBondContact O-N 2.79Å
107	Y	93.1	Very high	89	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-68.5	-41.9	178.8	-174.4	-116.6	0	0	0	112.2	F90 L94 V99 V101 S102 N104 L105 F109 L110 L111 H141 Y145	F90-Y107 HydrophobicContact CZ-CE2 4.25Å; L94-Y107 HydrophobicContact CD2-CD2 4.23Å; L94-Y107 HydrophobicContact CD2-CE2 4.09Å; V99-Y107 HydrophobicContact CG1-CD2 3.93Å; V99-Y107 HydrophobicContact CG1-CG 4.45Å; V101-Y107 HydrophobicContact CB-CE2 4.35Å; V101-Y107 HydrophobicContact CG1-CE1 4.15Å; V101-Y107 HydrophobicContact CG1-CE2 4.27Å; V101-Y107 HydrophobicContact CG2-CD2 4.41Å; V101-Y107 HydrophobicContact CG2-CE2 3.9Å; S102-Y107 WeakPolarHBondContact O-CD1 3.31Å; N104-Y107 PolarHBondContact O-N 3.19Å; N104-Y107 WeakPolarHBondContact OD1-CB 3.31Å; N104-Y107 PolarHBondContact OD1-N 3.31Å; L105-Y107 VanDerWaalsContact C-N 3.32Å; L105-Y107 PolarHBondContact O-N 2.98Å; Y107-F109 VanDerWaalsContact C-N 3.34Å; Y107-F109 PolarHBondContact O-N 2.99Å; Y107-L110 WeakPolarHBondContact O-CB 3.22Å; Y107-L110 PolarHBondContact O-N 3.39Å; Y107-L111 HydrophobicContact CD1-CD1 3.91Å; Y107-L111 HydrophobicContact CD1-CG 4.46Å; Y107-L111 HydrophobicContact CE1-CD1 3.45Å; Y107-L111 VanDerWaalsContact CE1-CD1 3.45Å; Y107-L111 HydrophobicContact CE1-CG 4.04Å; Y107-L111 HydrophobicContact CE2-CG 4.38Å; Y107-L111 PolarHBondContact O-N 3.38Å; Y107-H141 AromaticContact CZ-ND1 3.97Å; Y107-H141 PolarHBondContact OH-ND1 3.46Å; Y107-Y145 HydrophobicContact CD1-CD2 4.14Å; Y107-Y145 HydrophobicContact CD1-CG 4.33Å; Y107-Y145 AromaticContact CE1-CD2 3.52Å; Y107-Y145 HydrophobicContact CE1-CD2 3.52Å; Y107-Y145 AromaticContact CE1-CE2 3.72Å; Y107-Y145 HydrophobicContact CE1-CE2 3.72Å; Y107-Y145 HydrophobicContact CE1-CG 4.15Å
108	C	94.6	Very high	89.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-35.7	176.9	-70.6	0	0	0	0	113.1	N104 L105 E112 C147 L151	N104-C108 PolarHBondContact O-N 3.01Å; N104-C108 VanDerWaalsContact O-N 3.14Å; N104-C108 PolarHBondContact O-SG 3.14Å; N104-C108 VanDerWaalsContact O-SG 3.36Å; L105-C108 PolarHBondContact O-N 2.89Å; C108-E112 WeakPolarHBondContact O-CB 3.45Å; C108-E112 PolarHBondContact O-N 3.11Å; C108-C147 WeakPolarHBondContact CA-SG 3.03Å; C108-C147 HydrophobicContact CB-CB 3.54Å; C108-C147 WeakPolarHBondContact CB-SG 3.33Å; C108-C147 WeakPolarHBondContact SG-CA 3.47Å; C108-C147 WeakPolarHBondContact SG-CB 2.91Å; C108-C147 CovalentContact SG-SG 2.05Å; C108-C147 PolarHBondContact SG-SG 2.78Å; C108-L151 HydrophobicContact CB-CD1 4.3Å; C108-L151 HydrophobicContact CB-CD2 4.31Å; C108-L151 HydrophobicContact CB-CG 4.1Å
109	F	90.2	Very high	90.8	Very high	76 Å²	76	48.5 Å²	48.5	33%	0.333	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-42.2	170	-84.9	-58.1	0	0	0	112.2	L105 P106 Y107 L111 E112 Q113 L151 H154	L105-F109 HydrophobicContact CD1-CD2 3.92Å; L105-F109 HydrophobicContact CD1-CE2 3.51Å; L105-F109 HydrophobicContact CD1-CZ 4.21Å; L105-F109 HydrophobicContact CD2-CD2 4.48Å; L105-F109 HydrophobicContact CD2-CE2 3.88Å; L105-F109 HydrophobicContact CG-CD2 3.71Å; L105-F109 HydrophobicContact CG-CE2 3.48Å; L105-F109 VanDerWaalsContact CG-CE2 3.48Å; L105-F109 WeakPolarHBondContact O-CD2 3.44Å; L105-F109 PolarHBondContact O-N 3.28Å; P106-F109 PolarHBondContact O-N 3.45Å; Y107-F109 VanDerWaalsContact C-N 3.34Å; Y107-F109 PolarHBondContact O-N 2.99Å; F109-L111 PolarHBondContact O-N 2.95Å; F109-E112 PolarHBondContact O-N 3.37Å; F109-Q113 PolarHBondContact O-N 2.83Å; F109-L151 HydrophobicContact CD1-CD2 3.55Å; F109-L151 HydrophobicContact CD2-CD2 4.19Å; F109-L151 HydrophobicContact CE1-CD2 3.52Å; F109-L151 HydrophobicContact CE2-CD2 4.18Å; F109-L151 HydrophobicContact CG-CD2 3.88Å; F109-L151 HydrophobicContact CZ-CD2 3.85Å; F109-H154 AromaticContact CE2-CE1 3.81Å; F109-H154 AromaticContact CE2-ND1 3.84Å; F109-H154 AromaticContact CZ-CE1 3.63Å; F109-H154 AromaticContact CZ-ND1 3.44Å; F109-H154 WeakPolarHBondContact CZ-ND1 3.34Å
110	L	93.8	Very high	91.5	Very high	9 Å²	9	51.7 Å²	51.7	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-42	176.7	-178.3	60.5	0	0	0	111.9	F90 I93 L94 V99 P106 Y107 E112 Q113 Y114	F90-L110 HydrophobicContact CD2-CD1 4.07Å; F90-L110 HydrophobicContact CD2-CD2 4.02Å; F90-L110 HydrophobicContact CD2-CG 3.67Å; F90-L110 HydrophobicContact CE2-CD2 3.91Å; F90-L110 HydrophobicContact CE2-CG 3.7Å; I93-L110 HydrophobicContact CB-CD1 3.98Å; I93-L110 HydrophobicContact CB-CD2 4.18Å; I93-L110 HydrophobicContact CD1-CD1 3.54Å; I93-L110 HydrophobicContact CG1-CD1 4.36Å; I93-L110 HydrophobicContact CG2-CD1 3.85Å; I93-L110 HydrophobicContact CG2-CD2 3.77Å; I93-L110 HydrophobicContact CG2-CG 4.42Å; L94-L110 HydrophobicContact CD2-CD2 3.75Å; L94-L110 HydrophobicContact CG-CD2 4.01Å; V99-L110 HydrophobicContact CB-CD2 4.26Å; V99-L110 HydrophobicContact CG1-CB 4.5Å; V99-L110 HydrophobicContact CG1-CD2 3.96Å; V99-L110 HydrophobicContact CG2-CD2 4.43Å; P106-L110 WeakPolarHBondContact O-CB 3.25Å; P106-L110 PolarHBondContact O-N 2.79Å; Y107-L110 WeakPolarHBondContact O-CB 3.22Å; Y107-L110 PolarHBondContact O-N 3.39Å; L110-E112 VanDerWaalsContact C-N 3.35Å; L110-Q113 PolarHBondContact O-N 2.88Å; L110-Y114 WeakPolarHBondContact O-CB 3.4Å; L110-Y114 PolarHBondContact O-N 3.14Å
111	L	95.9	Very high	91.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-38.2	173.3	-76	173.1	0	0	0	112.5	F90 Y107 F109 Y114 D115 V138 H141 R142	F90-L111 HydrophobicContact CE2-CD2 4Å; F90-L111 HydrophobicContact CZ-CD2 4.08Å; Y107-L111 HydrophobicContact CD1-CD1 3.91Å; Y107-L111 HydrophobicContact CD1-CG 4.46Å; Y107-L111 HydrophobicContact CE1-CD1 3.45Å; Y107-L111 VanDerWaalsContact CE1-CD1 3.45Å; Y107-L111 HydrophobicContact CE1-CG 4.04Å; Y107-L111 HydrophobicContact CE2-CG 4.38Å; Y107-L111 PolarHBondContact O-N 3.38Å; F109-L111 PolarHBondContact O-N 2.95Å; L111-Y114 PolarHBondContact O-N 2.78Å; L111-D115 WeakPolarHBondContact O-CB 3.23Å; L111-D115 PolarHBondContact O-N 3.45Å; L111-V138 HydrophobicContact CD2-CG1 4.25Å; L111-H141 HydrophobicContact CD1-CB 3.85Å; L111-H141 HydrophobicContact CD2-CB 4.12Å; L111-R142 HydrophobicContact CB-CG 4.05Å; L111-R142 HydrophobicContact CD1-CG 4.11Å
112	E	93.4	Very high	91.9	Very high	47 Å²	47	46.3 Å²	46.3	22%	0.22	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-40.5	175.8	179.5	164.5	-104.6	0	0	112.1	C108 F109 L110 Y114 S116 R142 L151 R155	C108-E112 WeakPolarHBondContact O-CB 3.45Å; C108-E112 PolarHBondContact O-N 3.11Å; F109-E112 PolarHBondContact O-N 3.37Å; L110-E112 VanDerWaalsContact C-N 3.35Å; E112-Y114 VanDerWaalsContact C-N 3.34Å; E112-S116 WeakPolarHBondContact O-CB 3.46Å; E112-S116 PolarHBondContact O-N 3.31Å; E112-S116 PolarHBondContact O-OG 3.4Å; E112-R142 IonicContact OE1-NH2 3.61Å; E112-L151 HydrophobicContact CB-CD1 4.34Å; E112-R155 IonicContact OE1-CZ 2.87Å; E112-R155 IonicContact OE1-NH2 2.87Å; E112-R155 PolarHBondContact OE1-NH2 3Å; E112-R155 IonicContact OE2-NH2 3.86Å; E112-R155 PolarHBondContact OE2-NH2 3.46Å
113	Q	92.2	Very high	92.1	Very high	122 Å²	122	54.3 Å²	54.3	57%	0.57	29%	0.287	S	S	*	.	H	α-helix	trans	-63.7	-41.7	173.3	-174.6	178.1	3	0	0	111.2	F109 L110 S116 C117	F109-Q113 PolarHBondContact O-N 2.83Å; L110-Q113 PolarHBondContact O-N 2.88Å; Q113-S116 PolarHBondContact O-N 3.33Å; Q113-C117 PolarHBondContact O-N 3.15Å
114	Y	95.6	Very high	92	Very high	13 Å²	13	53.4 Å²	53.4	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-46.4	178.9	-170.3	-161.7	0	0	0	112.2	C86 A87 F90 L110 L111 E112 S116 C117 L118 I134 M137 V138	C86-Y114 VanDerWaalsContact C-CE2 3.45Å; C86-Y114 HydrophobicContact CB-CD2 3.87Å; C86-Y114 HydrophobicContact CB-CE2 3.59Å; C86-Y114 WeakPolarHBondContact O-CE2 3.36Å; A87-Y114 WeakPolarHBondContact CA-OH 3.37Å; A87-Y114 WeakPolarHBondContact CB-OH 3.04Å; F90-Y114 HydrophobicContact CB-CD1 3.96Å; F90-Y114 HydrophobicContact CB-CD2 4.18Å; F90-Y114 HydrophobicContact CB-CE1 4.06Å; F90-Y114 HydrophobicContact CB-CE2 4.29Å; F90-Y114 HydrophobicContact CB-CG 4.01Å; F90-Y114 AromaticContact CD1-CD1 3.95Å; F90-Y114 HydrophobicContact CD1-CD1 3.95Å; F90-Y114 AromaticContact CD1-CE1 3.8Å; F90-Y114 HydrophobicContact CD1-CE1 3.8Å; F90-Y114 AromaticContact CD2-CD1 3.39Å; F90-Y114 HydrophobicContact CD2-CD1 3.39Å; F90-Y114 HydrophobicContact CD2-CE1 4.1Å; F90-Y114 AromaticContact CD2-CG 3.73Å; F90-Y114 HydrophobicContact CD2-CG 3.73Å; F90-Y114 HydrophobicContact CE1-CD1 4.26Å; F90-Y114 HydrophobicContact CE1-CE1 4.22Å; F90-Y114 AromaticContact CE2-CD1 3.75Å; F90-Y114 HydrophobicContact CE2-CD1 3.75Å; F90-Y114 HydrophobicContact CE2-CE1 4.5Å; F90-Y114 HydrophobicContact CE2-CG 4.39Å; F90-Y114 AromaticContact CG-CD1 3.49Å; F90-Y114 HydrophobicContact CG-CD1 3.49Å; F90-Y114 VanDerWaalsContact CG-CD1 3.49Å; F90-Y114 AromaticContact CG-CE1 3.72Å; F90-Y114 HydrophobicContact CG-CE1 3.72Å; F90-Y114 AromaticContact CG-CG 3.95Å; F90-Y114 HydrophobicContact CG-CG 3.95Å; F90-Y114 HydrophobicContact CZ-CD1 4.17Å; L110-Y114 WeakPolarHBondContact O-CB 3.4Å; L110-Y114 PolarHBondContact O-N 3.14Å; L111-Y114 PolarHBondContact O-N 2.78Å; E112-Y114 VanDerWaalsContact C-N 3.34Å; Y114-S116 VanDerWaalsContact C-N 3.29Å; Y114-S116 PolarHBondContact O-N 3.28Å; Y114-C117 WeakPolarHBondContact O-CB 3.26Å; Y114-C117 PolarHBondContact O-N 3.5Å; Y114-L118 HydrophobicContact CD2-CD1 3.92Å; Y114-L118 HydrophobicContact CD2-CG 3.95Å; Y114-L118 HydrophobicContact CE2-CD1 3.84Å; Y114-L118 HydrophobicContact CE2-CD2 3.95Å; Y114-L118 HydrophobicContact CE2-CG 3.86Å; Y114-L118 HydrophobicContact CG-CD1 4.28Å; Y114-L118 VanDerWaalsContact O-CG 3.32Å; Y114-L118 WeakPolarHBondContact O-CG 3.35Å; Y114-L118 PolarHBondContact O-N 3.48Å; Y114-I134 HydrophobicContact CE1-CG2 3.75Å; Y114-I134 HydrophobicContact CE2-CG2 4.12Å; Y114-I134 WeakPolarHBondContact OH-CG2 3.43Å; Y114-M137 HydrophobicContact CE1-CE 4.08Å; Y114-V138 HydrophobicContact CD1-CG2 3.43Å; Y114-V138 VanDerWaalsContact CD1-CG2 3.43Å; Y114-V138 HydrophobicContact CE1-CG2 3.68Å; Y114-V138 HydrophobicContact CG-CG2 4.22Å
115	D	95.9	Very high	92.3	Very high	22 Å²	22	51.5 Å²	51.5	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-56.3	-44	173.3	-175.3	23.6	0	0	0	111	L111 C117 L118 R119 V138 R142	L111-D115 WeakPolarHBondContact O-CB 3.23Å; L111-D115 PolarHBondContact O-N 3.45Å; D115-C117 PolarHBondContact O-N 3.1Å; D115-L118 PolarHBondContact O-N 2.91Å; D115-R119 VanDerWaalsContact O-CG 3.31Å; D115-R119 WeakPolarHBondContact O-CG 3.38Å; D115-R119 PolarHBondContact O-N 3.44Å; D115-R119 IonicContact OD1-CZ 3.35Å; D115-R119 IonicContact OD1-NE 3.31Å; D115-R119 PolarHBondContact OD1-NE 2.92Å; D115-R119 IonicContact OD1-NH2 2.77Å; D115-R119 IonicContact OD2-CZ 3.9Å; D115-R119 IonicContact OD2-NE 2.67Å; D115-R119 PolarHBondContact OD2-NE 2.99Å; D115-R119 IonicContact OD2-NH2 3.74Å; D115-R119 PolarHBondContact OD2-NH2 3.01Å; D115-V138 HydrophobicContact CB-CG1 3.95Å; D115-R142 IonicContact OD2-NH1 3.83Å; D115-R142 PolarHBondContact OD2-NH1 3.16Å
116	S	94.6	Very high	92.5	Very high	67 Å²	67	58.4 Å²	58.4	47%	0.469	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-42.3	177.6	-59.4	0	0	0	0	112.5	E112 Q113 Y114 R119 A120	E112-S116 WeakPolarHBondContact O-CB 3.46Å; E112-S116 PolarHBondContact O-N 3.31Å; E112-S116 PolarHBondContact O-OG 3.4Å; Q113-S116 PolarHBondContact O-N 3.33Å; Y114-S116 VanDerWaalsContact C-N 3.29Å; Y114-S116 PolarHBondContact O-N 3.28Å; S116-R119 PolarHBondContact O-N 2.92Å; S116-A120 PolarHBondContact O-N 3.48Å
117	C	95.2	Very high	92.5	Very high	45 Å²	45	59 Å²	59	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-45.6	175.2	-170.3	0	0	0	0	111.7	C86 Q113 Y114 D115 R119 A120	C86-C117 WeakPolarHBondContact CA-SG 3.47Å; C86-C117 HydrophobicContact CB-CB 3.76Å; C86-C117 WeakPolarHBondContact CB-SG 3.17Å; C86-C117 WeakPolarHBondContact SG-CB 3.42Å; C86-C117 CovalentContact SG-SG 2.04Å; C86-C117 PolarHBondContact SG-SG 3.42Å; Q113-C117 PolarHBondContact O-N 3.15Å; Y114-C117 WeakPolarHBondContact O-CB 3.26Å; Y114-C117 PolarHBondContact O-N 3.5Å; D115-C117 PolarHBondContact O-N 3.1Å; C117-R119 VanDerWaalsContact C-N 3.35Å; C117-R119 PolarHBondContact O-N 3.09Å; C117-A120 WeakPolarHBondContact O-CB 3.5Å; C117-A120 PolarHBondContact O-N 3.46Å
118	L	95.1	Very high	92.3	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-37.3	177.8	-66.3	166.7	0	0	0	112.1	D83 C86 Y114 D115 A120 T121 S122 Y131 I134 T135 V138	D83-L118 HydrophobicContact CB-CD2 4.43Å; C86-L118 HydrophobicContact CB-CD2 4.19Å; C86-L118 HydrophobicContact CB-CG 4.5Å; Y114-L118 HydrophobicContact CD2-CD1 3.92Å; Y114-L118 HydrophobicContact CD2-CG 3.95Å; Y114-L118 HydrophobicContact CE2-CD1 3.84Å; Y114-L118 HydrophobicContact CE2-CD2 3.95Å; Y114-L118 HydrophobicContact CE2-CG 3.86Å; Y114-L118 HydrophobicContact CG-CD1 4.28Å; Y114-L118 VanDerWaalsContact O-CG 3.32Å; Y114-L118 WeakPolarHBondContact O-CG 3.35Å; Y114-L118 PolarHBondContact O-N 3.48Å; D115-L118 PolarHBondContact O-N 2.91Å; L118-A120 VanDerWaalsContact C-N 3.29Å; L118-A120 PolarHBondContact O-N 2.8Å; L118-T121 PolarHBondContact O-N 3.21Å; L118-T121 PolarHBondContact O-OG1 3.26Å; L118-T121 VanDerWaalsContact O-OG1 3.11Å; L118-S122 PolarHBondContact O-N 2.93Å; L118-Y131 HydrophobicContact CB-CE2 3.98Å; L118-Y131 HydrophobicContact CD2-CD2 4.14Å; L118-Y131 HydrophobicContact CD2-CE2 4.2Å; L118-Y131 WeakPolarHBondContact O-CE2 3.31Å; L118-Y131 PolarHBondContact O-OH 3.37Å; L118-I134 HydrophobicContact CD1-CG2 3.52Å; L118-I134 HydrophobicContact CD2-CG2 3.96Å; L118-I134 HydrophobicContact CG-CG2 4.38Å; L118-T135 HydrophobicContact CB-CG2 4.15Å; L118-T135 HydrophobicContact CD1-CG2 4.07Å; L118-V138 HydrophobicContact CD1-CG2 4.06Å
119	R	94.3	Very high	92.1	Very high	154 Å²	154	67.9 Å²	67.9	58%	0.581	36%	0.359	S	S	*	.	H	α-helix	trans	-64.5	-34.9	176.9	-73.3	176.3	-168.4	-154.7	5.6	112.2	D115 S116 C117 T121 S122	D115-R119 VanDerWaalsContact O-CG 3.31Å; D115-R119 WeakPolarHBondContact O-CG 3.38Å; D115-R119 PolarHBondContact O-N 3.44Å; D115-R119 IonicContact OD1-CZ 3.35Å; D115-R119 IonicContact OD1-NE 3.31Å; D115-R119 PolarHBondContact OD1-NE 2.92Å; D115-R119 IonicContact OD1-NH2 2.77Å; D115-R119 IonicContact OD2-CZ 3.9Å; D115-R119 IonicContact OD2-NE 2.67Å; D115-R119 PolarHBondContact OD2-NE 2.99Å; D115-R119 IonicContact OD2-NH2 3.74Å; D115-R119 PolarHBondContact OD2-NH2 3.01Å; S116-R119 PolarHBondContact O-N 2.92Å; C117-R119 VanDerWaalsContact C-N 3.35Å; C117-R119 PolarHBondContact O-N 3.09Å; R119-T121 PolarHBondContact O-N 3.44Å; R119-S122 VanDerWaalsContact O-CB 3.26Å; R119-S122 WeakPolarHBondContact O-CB 3.32Å; R119-S122 PolarHBondContact O-N 3.39Å; R119-S122 PolarHBondContact O-OG 3.24Å
120	A	92.1	Very high	92.2	Very high	88 Å²	88	72 Å²	72	73%	0.727	37%	0.372	S	S	*	.	H	α-helix	trans	-63.9	-29	177.2	0	0	0	0	0	112.8	S116 C117 L118	S116-A120 PolarHBondContact O-N 3.48Å; C117-A120 WeakPolarHBondContact O-CB 3.5Å; C117-A120 PolarHBondContact O-N 3.46Å; L118-A120 VanDerWaalsContact C-N 3.29Å; L118-A120 PolarHBondContact O-N 2.8Å
121	T	90.6	Very high	92.1	Very high	18 Å²	18	72.4 Å²	72.4	11%	0.11	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	2	178.4	64.7	0	0	0	0	113.8	E82 L118 R119 R123 S124 C125	E82-T121 HydrophobicContact CB-CG2 4.46Å; L118-T121 PolarHBondContact O-N 3.21Å; L118-T121 PolarHBondContact O-OG1 3.26Å; L118-T121 VanDerWaalsContact O-OG1 3.11Å; R119-T121 PolarHBondContact O-N 3.44Å; T121-R123 VanDerWaalsContact C-N 3.25Å; T121-R123 PolarHBondContact O-N 3.4Å; T121-R123 VanDerWaalsContact O-N 3.08Å; T121-S124 PolarHBondContact O-N 3.11Å; T121-S124 PolarHBondContact O-OG 2.96Å; T121-S124 VanDerWaalsContact O-OG 3.05Å; T121-C125 WeakPolarHBondContact O-CB 3.37Å; T121-C125 PolarHBondContact O-N 3.24Å; T121-C125 PolarHBondContact O-SG 3.24Å
122	S	91.8	Very high	92.1	Very high	49 Å²	49	76.6 Å²	76.6	34%	0.343	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-34.2	-174.6	59.2	0	0	0	0	115.1	L118 R119 R126 Y131	L118-S122 PolarHBondContact O-N 2.93Å; R119-S122 VanDerWaalsContact O-CB 3.26Å; R119-S122 WeakPolarHBondContact O-CB 3.32Å; R119-S122 PolarHBondContact O-N 3.39Å; R119-S122 PolarHBondContact O-OG 3.24Å; S122-R126 WeakPolarHBondContact O-CG 3.45Å; S122-R126 PolarHBondContact O-N 3.41Å; S122-Y131 WeakPolarHBondContact CA-OH 3.43Å; S122-Y131 VanDerWaalsContact CB-OH 3.27Å; S122-Y131 WeakPolarHBondContact CB-OH 3.49Å
123	R	89.2	Confident	92.1	Very high	208 Å²	208	77.6 Å²	77.6	79%	0.785	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-43.6	-179.2	-69.7	-176.5	175.9	-175.2	-0.5	112.6	T121	T121-R123 VanDerWaalsContact C-N 3.25Å; T121-R123 PolarHBondContact O-N 3.4Å; T121-R123 VanDerWaalsContact O-N 3.08Å
124	S	88	Confident	92.2	Very high	43 Å²	43	72 Å²	72	30%	0.301	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-24.4	177.1	47.4	0	0	0	0	112.5	G79 A80 T121	G79-S124 WeakPolarHBondContact O-CB 3.45Å; A80-S124 WeakPolarHBondContact O-CB 3.42Å; A80-S124 PolarHBondContact O-OG 3.28Å; T121-S124 PolarHBondContact O-N 3.11Å; T121-S124 PolarHBondContact O-OG 2.96Å; T121-S124 VanDerWaalsContact O-OG 3.05Å
125	C	91.3	Very high	92.2	Very high	0 Å²	0	73 Å²	73	0%	0	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	11.5	-175.8	-62.5	0	0	0	0	115.4	C81 T121 G127 N128 Y131	C81-C125 WeakPolarHBondContact CA-SG 3.17Å; C81-C125 HydrophobicContact CB-CB 4Å; C81-C125 WeakPolarHBondContact CB-SG 3.24Å; C81-C125 VanDerWaalsContact SG-CA 3.58Å; C81-C125 WeakPolarHBondContact SG-CB 3.27Å; C81-C125 CovalentContact SG-SG 2.03Å; C81-C125 PolarHBondContact SG-SG 3Å; T121-C125 WeakPolarHBondContact O-CB 3.37Å; T121-C125 PolarHBondContact O-N 3.24Å; T121-C125 PolarHBondContact O-SG 3.24Å; C125-G127 PolarHBondContact O-N 2.76Å; C125-G127 VanDerWaalsContact O-N 3.09Å; C125-N128 HydrophobicContact CB-CB 4.32Å; C125-N128 PolarHBondContact O-N 3.19Å; C125-Y131 HydrophobicContact CB-CD1 3.8Å; C125-Y131 HydrophobicContact CB-CD2 3.54Å; C125-Y131 HydrophobicContact CB-CE1 4.26Å; C125-Y131 HydrophobicContact CB-CE2 4.02Å; C125-Y131 HydrophobicContact CB-CG 3.41Å; C125-Y131 VanDerWaalsContact CB-CG 3.41Å
126	R	89.2	Confident	92.2	Very high	193 Å²	193	75.7 Å²	75.7	73%	0.728	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-38.8	-175.6	-79.7	-171.3	156	127.8	-4.7	114.7	S122 H132	S122-R126 WeakPolarHBondContact O-CG 3.45Å; S122-R126 PolarHBondContact O-N 3.41Å; R126-H132 PolarHBondContact O-NE2 3.08Å
127	G	86.5	Confident	92.2	Very high	82 Å²	82	75.3 Å²	75.3	85%	0.845	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	9.6	179.8	0	0	0	0	0	115	C125	C125-G127 PolarHBondContact O-N 2.76Å; C125-G127 VanDerWaalsContact O-N 3.09Å
128	N	88.8	Confident	92.2	Very high	45 Å²	45	73.2 Å²	73.2	24%	0.241	38%	0.38	C	S	.	.			trans	-88.8	115.9	-179.1	-176.2	-31.9	0	0	0	110.2	C81 C125 R130 Y131 H132	C81-N128 HydrophobicContact CB-CB 4.38Å; C81-N128 PolarHBondContact SG-ND2 3.34Å; C125-N128 HydrophobicContact CB-CB 4.32Å; C125-N128 PolarHBondContact O-N 3.19Å; N128-R130 VanDerWaalsContact C-N 3.35Å; N128-R130 PolarHBondContact O-N 2.88Å; N128-R130 WeakPolarHBondContact OD1-CA 3.1Å; N128-R130 VanDerWaalsContact OD1-CB 3.23Å; N128-R130 WeakPolarHBondContact OD1-CB 3.41Å; N128-R130 PolarHBondContact OD1-N 2.89Å; N128-Y131 WeakPolarHBondContact O-CB 3.47Å; N128-Y131 PolarHBondContact O-N 3.17Å; N128-Y131 PolarHBondContact OD1-N 2.82Å; N128-Y131 VanDerWaalsContact OD1-N 3.15Å; N128-H132 PolarHBondContact O-CD2 3.22Å; N128-H132 PolarHBondContact O-N 3.04Å
129	L	91.1	Very high	92.2	Very high	145 Å²	145	76 Å²	76	76%	0.759	40%	0.403	S	S	*	.	H	α-helix	trans	-64.1	-37.5	178.8	-178.5	62.8	0	0	0	112.7	Y131 H132 S133	L129-Y131 VanDerWaalsContact C-N 3.35Å; L129-H132 PolarHBondContact O-N 3.42Å; L129-S133 WeakPolarHBondContact O-CB 3.23Å; L129-S133 PolarHBondContact O-N 3.25Å
130	R	91.4	Very high	92.3	Very high	161 Å²	161	73 Å²	73	61%	0.608	40%	0.399	S	S	*	.	H	α-helix	trans	-62.8	-43.6	178.1	-177.3	61.4	175.8	-174.3	1.3	110.9	D83 N128 H132 S133 I134	D83-R130 WeakPolarHBondContact OD2-CG 3.26Å; N128-R130 VanDerWaalsContact C-N 3.35Å; N128-R130 PolarHBondContact O-N 2.88Å; N128-R130 WeakPolarHBondContact OD1-CA 3.1Å; N128-R130 VanDerWaalsContact OD1-CB 3.23Å; N128-R130 WeakPolarHBondContact OD1-CB 3.41Å; N128-R130 PolarHBondContact OD1-N 2.89Å; R130-H132 PolarHBondContact O-N 3.11Å; R130-S133 PolarHBondContact O-N 3.41Å; R130-I134 HydrophobicContact CG-CD1 3.88Å; R130-I134 WeakPolarHBondContact O-CB 3.05Å; R130-I134 VanDerWaalsContact O-CG1 3.26Å; R130-I134 WeakPolarHBondContact O-CG1 3.49Å; R130-I134 PolarHBondContact O-N 3.14Å
131	Y	92.7	Very high	92.5	Very high	19 Å²	19	71 Å²	71	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-54.8	-52.1	173.5	172.6	-99.3	0	0	0	111.9	D83 L118 S122 C125 N128 L129 S133 I134 T135	D83-Y131 HydrophobicContact CB-CD2 4.32Å; D83-Y131 PolarHBondContact OD2-N 2.92Å; L118-Y131 HydrophobicContact CB-CE2 3.98Å; L118-Y131 HydrophobicContact CD2-CD2 4.14Å; L118-Y131 HydrophobicContact CD2-CE2 4.2Å; L118-Y131 WeakPolarHBondContact O-CE2 3.31Å; L118-Y131 PolarHBondContact O-OH 3.37Å; S122-Y131 WeakPolarHBondContact CA-OH 3.43Å; S122-Y131 VanDerWaalsContact CB-OH 3.27Å; S122-Y131 WeakPolarHBondContact CB-OH 3.49Å; C125-Y131 HydrophobicContact CB-CD1 3.8Å; C125-Y131 HydrophobicContact CB-CD2 3.54Å; C125-Y131 HydrophobicContact CB-CE1 4.26Å; C125-Y131 HydrophobicContact CB-CE2 4.02Å; C125-Y131 HydrophobicContact CB-CG 3.41Å; C125-Y131 VanDerWaalsContact CB-CG 3.41Å; N128-Y131 WeakPolarHBondContact O-CB 3.47Å; N128-Y131 PolarHBondContact O-N 3.17Å; N128-Y131 PolarHBondContact OD1-N 2.82Å; N128-Y131 VanDerWaalsContact OD1-N 3.15Å; L129-Y131 VanDerWaalsContact C-N 3.35Å; Y131-S133 VanDerWaalsContact C-N 3.34Å; Y131-S133 PolarHBondContact O-N 2.84Å; Y131-I134 PolarHBondContact O-N 2.84Å; Y131-T135 HydrophobicContact CD1-CG2 4.34Å; Y131-T135 HydrophobicContact CD2-CG2 4.27Å; Y131-T135 HydrophobicContact CE1-CG2 3.95Å; Y131-T135 HydrophobicContact CE2-CG2 3.88Å; Y131-T135 HydrophobicContact CG-CG2 4.49Å; Y131-T135 WeakPolarHBondContact O-CG2 3.36Å; Y131-T135 PolarHBondContact O-N 3.17Å; Y131-T135 PolarHBondContact O-OG1 3.21Å
132	H	94.5	Very high	92.7	Very high	88 Å²	88	72.7 Å²	72.7	41%	0.407	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-34.4	-179.7	-73.1	-64.9	0	0	0	113.3	R126 N128 L129 R130 T135 T136	R126-H132 PolarHBondContact O-NE2 3.08Å; N128-H132 PolarHBondContact O-CD2 3.22Å; N128-H132 PolarHBondContact O-N 3.04Å; L129-H132 PolarHBondContact O-N 3.42Å; R130-H132 PolarHBondContact O-N 3.11Å; H132-T135 WeakPolarHBondContact CA-OG1 3.47Å; H132-T135 PolarHBondContact O-OG1 3.17Å; H132-T136 WeakPolarHBondContact O-CB 3.45Å; H132-T136 PolarHBondContact O-N 3.05Å; H132-T136 VanDerWaalsContact O-N 3.1Å; H132-T136 PolarHBondContact O-OG1 3.2Å
133	S	94.7	Very high	92.8	Very high	67 Å²	67	78.8 Å²	78.8	47%	0.469	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-46.8	173.3	176.1	0	0	0	0	111.2	L129 R130 Y131 T136 M137	L129-S133 WeakPolarHBondContact O-CB 3.23Å; L129-S133 PolarHBondContact O-N 3.25Å; R130-S133 PolarHBondContact O-N 3.41Å; Y131-S133 VanDerWaalsContact C-N 3.34Å; Y131-S133 PolarHBondContact O-N 2.84Å; S133-T136 PolarHBondContact O-N 3.46Å; S133-M137 PolarHBondContact O-N 3.36Å
134	I	94.6	Very high	93	Very high	6 Å²	6	74.9 Å²	74.9	3%	0.031	39%	0.39	C	S	.	.	H	α-helix	trans	-65	-47.8	178.3	-69	168.5	0	0	0	110.9	A87 Y114 L118 R130 Y131 T136 M137 V138	A87-I134 HydrophobicContact CB-CD1 4.44Å; Y114-I134 HydrophobicContact CE1-CG2 3.75Å; Y114-I134 HydrophobicContact CE2-CG2 4.12Å; Y114-I134 WeakPolarHBondContact OH-CG2 3.43Å; L118-I134 HydrophobicContact CD1-CG2 3.52Å; L118-I134 HydrophobicContact CD2-CG2 3.96Å; L118-I134 HydrophobicContact CG-CG2 4.38Å; R130-I134 HydrophobicContact CG-CD1 3.88Å; R130-I134 WeakPolarHBondContact O-CB 3.05Å; R130-I134 VanDerWaalsContact O-CG1 3.26Å; R130-I134 WeakPolarHBondContact O-CG1 3.49Å; R130-I134 PolarHBondContact O-N 3.14Å; Y131-I134 PolarHBondContact O-N 2.84Å; I134-T136 VanDerWaalsContact C-N 3.26Å; I134-T136 PolarHBondContact O-N 2.86Å; I134-M137 HydrophobicContact CB-CE 4.39Å; I134-M137 HydrophobicContact CG2-CE 3.91Å; I134-M137 PolarHBondContact O-N 3.19Å; I134-M137 VanDerWaalsContact O-N 3.12Å; I134-V138 HydrophobicContact CG2-CG2 4.28Å; I134-V138 WeakPolarHBondContact O-CG2 3.05Å; I134-V138 PolarHBondContact O-N 2.62Å
135	T	94.5	Very high	93.2	Very high	32 Å²	32	74.8 Å²	74.8	20%	0.196	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-37.9	-179	54.2	0	0	0	0	111.7	L118 Y131 H132 A139	L118-T135 HydrophobicContact CB-CG2 4.15Å; L118-T135 HydrophobicContact CD1-CG2 4.07Å; Y131-T135 HydrophobicContact CD1-CG2 4.34Å; Y131-T135 HydrophobicContact CD2-CG2 4.27Å; Y131-T135 HydrophobicContact CE1-CG2 3.95Å; Y131-T135 HydrophobicContact CE2-CG2 3.88Å; Y131-T135 HydrophobicContact CG-CG2 4.49Å; Y131-T135 WeakPolarHBondContact O-CG2 3.36Å; Y131-T135 PolarHBondContact O-N 3.17Å; Y131-T135 PolarHBondContact O-OG1 3.21Å; H132-T135 WeakPolarHBondContact CA-OG1 3.47Å; H132-T135 PolarHBondContact O-OG1 3.17Å; T135-A139 WeakPolarHBondContact O-CB 3.38Å; T135-A139 PolarHBondContact O-N 2.73Å
136	T	95.4	Very high	93.3	Very high	79 Å²	79	81.8 Å²	81.8	49%	0.485	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-45.3	173.7	-57.8	0	0	0	0	111.6	H132 S133 I134 A139 N140	H132-T136 WeakPolarHBondContact O-CB 3.45Å; H132-T136 PolarHBondContact O-N 3.05Å; H132-T136 VanDerWaalsContact O-N 3.1Å; H132-T136 PolarHBondContact O-OG1 3.2Å; S133-T136 PolarHBondContact O-N 3.46Å; I134-T136 VanDerWaalsContact C-N 3.26Å; I134-T136 PolarHBondContact O-N 2.86Å; T136-A139 PolarHBondContact O-N 3.09Å; T136-N140 WeakPolarHBondContact O-CB 3.39Å; T136-N140 VanDerWaalsContact O-CG 3.29Å; T136-N140 PolarHBondContact O-N 3.06Å; T136-N140 PolarHBondContact O-ND2 2.97Å
137	M	95.2	Very high	93.5	Very high	59 Å²	59	72.6 Å²	72.6	29%	0.291	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-45.2	177.2	171.5	-87.3	-50.5	0	0	112	Y114 S133 I134 A139 N140 H141	Y114-M137 HydrophobicContact CE1-CE 4.08Å; S133-M137 PolarHBondContact O-N 3.36Å; I134-M137 HydrophobicContact CB-CE 4.39Å; I134-M137 HydrophobicContact CG2-CE 3.91Å; I134-M137 PolarHBondContact O-N 3.19Å; I134-M137 VanDerWaalsContact O-N 3.12Å; M137-A139 PolarHBondContact O-N 3.17Å; M137-N140 PolarHBondContact O-N 2.88Å; M137-H141 PolarHBondContact O-CD2 2.91Å; M137-H141 PolarHBondContact O-N 3.46Å
138	V	95.7	Very high	93.9	Very high	1 Å²	1	76 Å²	76	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-44.9	175.5	173.3	0	0	0	0	111	L111 Y114 D115 L118 I134 N140 H141 R142	L111-V138 HydrophobicContact CD2-CG1 4.25Å; Y114-V138 HydrophobicContact CD1-CG2 3.43Å; Y114-V138 VanDerWaalsContact CD1-CG2 3.43Å; Y114-V138 HydrophobicContact CE1-CG2 3.68Å; Y114-V138 HydrophobicContact CG-CG2 4.22Å; D115-V138 HydrophobicContact CB-CG1 3.95Å; L118-V138 HydrophobicContact CD1-CG2 4.06Å; I134-V138 HydrophobicContact CG2-CG2 4.28Å; I134-V138 WeakPolarHBondContact O-CG2 3.05Å; I134-V138 PolarHBondContact O-N 2.62Å; V138-N140 PolarHBondContact O-N 3.28Å; V138-H141 PolarHBondContact O-N 3.49Å; V138-R142 HydrophobicContact CG1-CG 4.47Å; V138-R142 VanDerWaalsContact O-CG 3.32Å; V138-R142 WeakPolarHBondContact O-CG 3.42Å; V138-R142 PolarHBondContact O-N 3.3Å
139	A	95.5	Very high	94	Very high	58 Å²	58	76.7 Å²	76.7	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-42.2	177.6	0	0	0	0	0	112.3	T135 T136 M137 R142 K143	T135-A139 WeakPolarHBondContact O-CB 3.38Å; T135-A139 PolarHBondContact O-N 2.73Å; T136-A139 PolarHBondContact O-N 3.09Å; M137-A139 PolarHBondContact O-N 3.17Å; A139-R142 PolarHBondContact O-N 3.08Å; A139-K143 PolarHBondContact O-N 3.38Å
140	N	95.9	Very high	94	Very high	93 Å²	93	71.7 Å²	71.7	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-63.8	-47.9	176.5	-74.3	-18.4	0	0	0	111.5	T136 M137 V138 R142 K143 E144	T136-N140 WeakPolarHBondContact O-CB 3.39Å; T136-N140 VanDerWaalsContact O-CG 3.29Å; T136-N140 PolarHBondContact O-N 3.06Å; T136-N140 PolarHBondContact O-ND2 2.97Å; M137-N140 PolarHBondContact O-N 2.88Å; V138-N140 PolarHBondContact O-N 3.28Å; N140-R142 PolarHBondContact O-N 3.15Å; N140-K143 WeakPolarHBondContact O-CB 3.21Å; N140-K143 PolarHBondContact O-N 3Å; N140-K143 VanDerWaalsContact O-N 3.11Å; N140-E144 WeakPolarHBondContact O-CB 3.23Å; N140-E144 PolarHBondContact O-N 3.4Å
141	H	95.2	Very high	94	Very high	46 Å²	46	64.1 Å²	64.1	21%	0.213	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-42.7	178	-79.6	-147.5	0	0	0	111.8	Y107 L111 M137 V138 K143 E144 Y145	Y107-H141 AromaticContact CZ-ND1 3.97Å; Y107-H141 PolarHBondContact OH-ND1 3.46Å; L111-H141 HydrophobicContact CD1-CB 3.85Å; L111-H141 HydrophobicContact CD2-CB 4.12Å; M137-H141 PolarHBondContact O-CD2 2.91Å; M137-H141 PolarHBondContact O-N 3.46Å; V138-H141 PolarHBondContact O-N 3.49Å; H141-K143 PolarHBondContact O-N 3.41Å; H141-E144 PolarHBondContact O-N 3.23Å; H141-Y145 HydrophobicContact CB-CD2 4.14Å; H141-Y145 HydrophobicContact CB-CE2 4.3Å; H141-Y145 VanDerWaalsContact O-CD2 3.25Å; H141-Y145 WeakPolarHBondContact O-CD2 3.47Å; H141-Y145 PolarHBondContact O-N 3.04Å
142	R	94.5	Very high	93.8	Very high	53 Å²	53	67.2 Å²	67.2	20%	0.2	34%	0.343	C	S	.	.	H	α-helix	trans	-58.2	-34.9	176.3	-73.9	-174	75.3	178.3	7.4	112.4	L111 E112 D115 V138 A139 N140 C147	L111-R142 HydrophobicContact CB-CG 4.05Å; L111-R142 HydrophobicContact CD1-CG 4.11Å; E112-R142 IonicContact OE1-NH2 3.61Å; D115-R142 IonicContact OD2-NH1 3.83Å; D115-R142 PolarHBondContact OD2-NH1 3.16Å; V138-R142 HydrophobicContact CG1-CG 4.47Å; V138-R142 VanDerWaalsContact O-CG 3.32Å; V138-R142 WeakPolarHBondContact O-CG 3.42Å; V138-R142 PolarHBondContact O-N 3.3Å; A139-R142 PolarHBondContact O-N 3.08Å; N140-R142 PolarHBondContact O-N 3.15Å; R142-C147 HydrophobicContact CB-CB 4.35Å; R142-C147 HydrophobicContact CG-CB 4.49Å; R142-C147 WeakPolarHBondContact O-CB 3.32Å; R142-C147 PolarHBondContact O-N 3.3Å
143	K	94.5	Very high	93.4	Very high	176 Å²	176	71.8 Å²	71.8	77%	0.765	36%	0.357	S	S	*	.	H	α-helix	trans	-75.7	-48.5	176.3	-175.6	-180	179.6	179.5	0	111.8	A139 N140 H141 Y145 K146	A139-K143 PolarHBondContact O-N 3.38Å; N140-K143 WeakPolarHBondContact O-CB 3.21Å; N140-K143 PolarHBondContact O-N 3Å; N140-K143 VanDerWaalsContact O-N 3.11Å; H141-K143 PolarHBondContact O-N 3.41Å; K143-Y145 PolarHBondContact O-N 2.03Å; K143-K146 PolarHBondContact O-N 3.31Å
144	E	92.9	Very high	92.8	Very high	126 Å²	126	71.6 Å²	71.6	59%	0.589	35%	0.348	S	S	*	.	H	α-helix	trans	-59.5	-46.5	-178	-177.3	170.1	-178.7	0	0	112	N140 H141 K146	N140-E144 WeakPolarHBondContact O-CB 3.23Å; N140-E144 PolarHBondContact O-N 3.4Å; H141-E144 PolarHBondContact O-N 3.23Å; E144-K146 VanDerWaalsContact C-N 3.27Å; E144-K146 PolarHBondContact O-N 3.31Å
145	Y	92.5	Very high	92.3	Very high	42 Å²	42	75.8 Å²	75.8	17%	0.165	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	15.6	-180	-61.9	-68.1	0	0	0	113.8	V101 S102 S103 Y107 H141 K143 C147	V101-Y145 HydrophobicContact CG1-CE2 4.2Å; V101-Y145 WeakPolarHBondContact CG1-OH 3.02Å; S102-Y145 VanDerWaalsContact C-CD1 3.43Å; S103-Y145 PolarHBondContact OG-O 3.38Å; Y107-Y145 HydrophobicContact CD1-CD2 4.14Å; Y107-Y145 HydrophobicContact CD1-CG 4.33Å; Y107-Y145 AromaticContact CE1-CD2 3.52Å; Y107-Y145 HydrophobicContact CE1-CD2 3.52Å; Y107-Y145 AromaticContact CE1-CE2 3.72Å; Y107-Y145 HydrophobicContact CE1-CE2 3.72Å; Y107-Y145 HydrophobicContact CE1-CG 4.15Å; H141-Y145 HydrophobicContact CB-CD2 4.14Å; H141-Y145 HydrophobicContact CB-CE2 4.3Å; H141-Y145 VanDerWaalsContact O-CD2 3.25Å; H141-Y145 WeakPolarHBondContact O-CD2 3.47Å; H141-Y145 PolarHBondContact O-N 3.04Å; K143-Y145 PolarHBondContact O-N 2.03Å; Y145-C147 PolarHBondContact O-N 3.18Å
146	K	94.5	Very high	91.7	Very high	146 Å²	146	77.4 Å²	77.4	64%	0.635	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	36.6	175.7	-58.5	177.3	-177.8	173.1	0	113.5	K143 E144 F148 A149 L150	K143-K146 PolarHBondContact O-N 3.31Å; E144-K146 VanDerWaalsContact C-N 3.27Å; E144-K146 PolarHBondContact O-N 3.31Å; K146-F148 PolarHBondContact O-N 2.04Å; K146-A149 PolarHBondContact O-N 2.99Å; K146-A149 VanDerWaalsContact O-N 3.16Å; K146-L150 PolarHBondContact O-N 3.05Å
147	C	94	Very high	91	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.5	-30.4	-171.3	-73	0	0	0	0	113.6	C108 R142 Y145 A149 L150 L151	C108-C147 WeakPolarHBondContact CA-SG 3.03Å; C108-C147 HydrophobicContact CB-CB 3.54Å; C108-C147 WeakPolarHBondContact CB-SG 3.33Å; C108-C147 WeakPolarHBondContact SG-CA 3.47Å; C108-C147 WeakPolarHBondContact SG-CB 2.91Å; C108-C147 CovalentContact SG-SG 2.05Å; C108-C147 PolarHBondContact SG-SG 2.78Å; R142-C147 HydrophobicContact CB-CB 4.35Å; R142-C147 HydrophobicContact CG-CB 4.49Å; R142-C147 WeakPolarHBondContact O-CB 3.32Å; R142-C147 PolarHBondContact O-N 3.3Å; Y145-C147 PolarHBondContact O-N 3.18Å; C147-A149 PolarHBondContact O-N 2.84Å; C147-L150 PolarHBondContact O-N 3.31Å; C147-L151 HydrophobicContact CB-CD1 4.46Å; C147-L151 VanDerWaalsContact O-CB 3.32Å; C147-L151 WeakPolarHBondContact O-CB 3.06Å; C147-L151 VanDerWaalsContact O-CG 3.26Å; C147-L151 WeakPolarHBondContact O-CG 3.42Å; C147-L151 PolarHBondContact O-N 2.75Å
148	F	93.1	Very high	89.8	Confident	154 Å²	154	79.4 Å²	79.4	68%	0.675	39%	0.393	S	S	*	.	H	α-helix	trans	-57.7	-49.5	175.5	-176	-95.8	0	0	0	111.7	K146 E152	K146-F148 PolarHBondContact O-N 2.04Å; F148-E152 VanDerWaalsContact O-CB 3.29Å; F148-E152 WeakPolarHBondContact O-CB 3.42Å; F148-E152 PolarHBondContact O-N 3.1Å
149	A	91.8	Very high	88.5	Confident	59 Å²	59	83.5 Å²	83.5	49%	0.488	43%	0.427	S	S	.	.	H	α-helix	trans	-68.8	-37.6	-179	0	0	0	0	0	112.7	K146 C147 R153	K146-A149 PolarHBondContact O-N 2.99Å; K146-A149 VanDerWaalsContact O-N 3.16Å; C147-A149 PolarHBondContact O-N 2.84Å; A149-R153 WeakPolarHBondContact O-CB 3.28Å; A149-R153 PolarHBondContact O-N 3.07Å; A149-R153 VanDerWaalsContact O-N 3.09Å
150	L	91	Very high	86.6	Confident	41 Å²	41	83.7 Å²	83.7	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-67.5	-47.4	178.7	-73.7	173.3	0	0	0	112.3	K146 C147 H154	K146-L150 PolarHBondContact O-N 3.05Å; C147-L150 PolarHBondContact O-N 3.31Å; L150-H154 WeakPolarHBondContact O-CB 3.44Å; L150-H154 PolarHBondContact O-N 3.07Å; L150-H154 VanDerWaalsContact O-N 3.11Å
151	L	90.3	Very high	84.3	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.005	44%	0.441	C	S	.	.	H	α-helix	trans	-66.2	-40.3	179	-70.1	167.6	0	0	0	111.2	L105 C108 F109 E112 C147 H154 R155	L105-L151 HydrophobicContact CD1-CD2 4.08Å; C108-L151 HydrophobicContact CB-CD1 4.3Å; C108-L151 HydrophobicContact CB-CD2 4.31Å; C108-L151 HydrophobicContact CB-CG 4.1Å; F109-L151 HydrophobicContact CD1-CD2 3.55Å; F109-L151 HydrophobicContact CD2-CD2 4.19Å; F109-L151 HydrophobicContact CE1-CD2 3.52Å; F109-L151 HydrophobicContact CE2-CD2 4.18Å; F109-L151 HydrophobicContact CG-CD2 3.88Å; F109-L151 HydrophobicContact CZ-CD2 3.85Å; E112-L151 HydrophobicContact CB-CD1 4.34Å; C147-L151 HydrophobicContact CB-CD1 4.46Å; C147-L151 VanDerWaalsContact O-CB 3.32Å; C147-L151 WeakPolarHBondContact O-CB 3.06Å; C147-L151 VanDerWaalsContact O-CG 3.26Å; C147-L151 WeakPolarHBondContact O-CG 3.42Å; C147-L151 PolarHBondContact O-N 2.75Å; L151-H154 PolarHBondContact O-N 2.89Å; L151-R155 WeakPolarHBondContact O-CG 3.1Å; L151-R155 PolarHBondContact O-N 2.77Å
152	E	89.8	Confident	81.8	Confident	84 Å²	84	84.3 Å²	84.3	39%	0.393	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-49.1	178.2	-169.2	57	-152.5	0	0	111.5	F148 H154 R155 S156	F148-E152 VanDerWaalsContact O-CB 3.29Å; F148-E152 WeakPolarHBondContact O-CB 3.42Å; F148-E152 PolarHBondContact O-N 3.1Å; E152-H154 PolarHBondContact O-N 3.45Å; E152-R155 PolarHBondContact O-N 2.9Å; E152-R155 VanDerWaalsContact O-N 3.09Å; E152-R155 IonicContact OE2-NH1 2.76Å; E152-S156 PolarHBondContact O-N 3.46Å; E152-S156 PolarHBondContact O-OG 3.13Å
153	R	85.8	Confident	79.2	Confident	185 Å²	185	89.1 Å²	89.1	70%	0.698	49%	0.491	S	S	*	.	H	α-helix	trans	-54.3	-43.1	175	-176.5	-173.7	-64.1	179.2	-2.7	111.8	A149 A157	A149-R153 WeakPolarHBondContact O-CB 3.28Å; A149-R153 PolarHBondContact O-N 3.07Å; A149-R153 VanDerWaalsContact O-N 3.09Å; R153-A157 WeakPolarHBondContact O-CB 2.85Å; R153-A157 PolarHBondContact O-N 2Å
154	H	82.8	Confident	76.7	Confident	62 Å²	62	89.9 Å²	89.9	29%	0.287	50%	0.497	S	S	.	.	H	α-helix	trans	-67.2	-40.7	178.8	-179.9	-97.1	0	0	0	112.5	L105 F109 L150 L151 E152 A157 I158	L105-H154 HydrophobicContact CD1-CB 3.74Å; L105-H154 HydrophobicContact CD2-CB 4.13Å; L105-H154 WeakPolarHBondContact CD2-CD2 3.35Å; F109-H154 AromaticContact CE2-CE1 3.81Å; F109-H154 AromaticContact CE2-ND1 3.84Å; F109-H154 AromaticContact CZ-CE1 3.63Å; F109-H154 AromaticContact CZ-ND1 3.44Å; F109-H154 WeakPolarHBondContact CZ-ND1 3.34Å; L150-H154 WeakPolarHBondContact O-CB 3.44Å; L150-H154 PolarHBondContact O-N 3.07Å; L150-H154 VanDerWaalsContact O-N 3.11Å; L151-H154 PolarHBondContact O-N 2.89Å; E152-H154 PolarHBondContact O-N 3.45Å; H154-A157 PolarHBondContact O-N 3.46Å; H154-I158 WeakPolarHBondContact CE1-CD1 3.3Å; H154-I158 WeakPolarHBondContact O-CG1 3.44Å; H154-I158 PolarHBondContact O-N 2.96Å; H154-I158 VanDerWaalsContact O-N 3.09Å
155	R	83.8	Confident	73.9	Confident	95 Å²	95	87.3 Å²	87.3	36%	0.358	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.4	-71.4	179.3	-166.3	119.4	4.1	111.9	E112 L151 E152 A157 I158 A159	E112-R155 IonicContact OE1-CZ 2.87Å; E112-R155 IonicContact OE1-NH2 2.87Å; E112-R155 PolarHBondContact OE1-NH2 3Å; E112-R155 IonicContact OE2-NH2 3.86Å; E112-R155 PolarHBondContact OE2-NH2 3.46Å; L151-R155 WeakPolarHBondContact O-CG 3.1Å; L151-R155 PolarHBondContact O-N 2.77Å; E152-R155 PolarHBondContact O-N 2.9Å; E152-R155 VanDerWaalsContact O-N 3.09Å; E152-R155 IonicContact OE2-NH1 2.76Å; R155-A157 VanDerWaalsContact C-N 3.32Å; R155-A157 PolarHBondContact O-N 2.8Å; R155-I158 PolarHBondContact O-N 2.79Å; R155-A159 WeakPolarHBondContact O-CB 2.94Å; R155-A159 PolarHBondContact O-N 3.2Å
156	S	82.1	Confident	71.4	Confident	65 Å²	65	90.3 Å²	90.3	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-38.7	175.7	-48.2	0	0	0	0	111.9	E152 A159 G160	E152-S156 PolarHBondContact O-N 3.46Å; E152-S156 PolarHBondContact O-OG 3.13Å; S156-A159 PolarHBondContact O-N 3.25Å; S156-G160 PolarHBondContact O-N 2.8Å
157	A	79.8	Confident	68.5	Low	66 Å²	66	90.7 Å²	90.7	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-64.1	-39.4	176.1	0	0	0	0	0	112.6	R153 H154 R155 G161	R153-A157 WeakPolarHBondContact O-CB 2.85Å; R153-A157 PolarHBondContact O-N 2Å; H154-A157 PolarHBondContact O-N 3.46Å; R155-A157 VanDerWaalsContact C-N 3.32Å; R155-A157 PolarHBondContact O-N 2.8Å; A157-G161 PolarHBondContact O-N 2.88Å
158	I	70.8	Confident	65.8	Low	115 Å²	115	94.3 Å²	94.3	59%	0.59	58%	0.579	S	S	*	*	H	α-helix	trans	-70	-42.5	175.3	-67.1	175.1	0	0	0	111.1	H154 R155 G160 G161	H154-I158 WeakPolarHBondContact CE1-CD1 3.3Å; H154-I158 WeakPolarHBondContact O-CG1 3.44Å; H154-I158 PolarHBondContact O-N 2.96Å; H154-I158 VanDerWaalsContact O-N 3.09Å; R155-I158 PolarHBondContact O-N 2.79Å; I158-G160 VanDerWaalsContact C-N 3.33Å; I158-G160 PolarHBondContact O-N 3.49Å; I158-G161 PolarHBondContact O-N 3.36Å
159	A	68.6	Low	63.2	Low	86 Å²	86	95.7 Å²	95.7	71%	0.711	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-32	-179.2	0	0	0	0	0	112.9	R155 S156	R155-A159 WeakPolarHBondContact O-CB 2.94Å; R155-A159 PolarHBondContact O-N 3.2Å; S156-A159 PolarHBondContact O-N 3.25Å
160	G	54.5	Low	60.6	Low	62 Å²	62	96.4 Å²	96.4	64%	0.639	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-4.1	177.8	0	0	0	0	0	115.1	S156 I158	S156-G160 PolarHBondContact O-N 2.8Å; I158-G160 VanDerWaalsContact C-N 3.33Å; I158-G160 PolarHBondContact O-N 3.49Å
161	G	47.2	Very low	57.9	Low	61 Å²	61	101.7 Å²	101.7	63%	0.629	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	15.3	-168.9	0	0	0	0	0	116.4	A157 I158	A157-G161 PolarHBondContact O-N 2.88Å; I158-G161 PolarHBondContact O-N 3.36Å
162	A	44.4	Very low	55.9	Low	91 Å²	91	106.9 Å²	106.9	75%	0.752	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-3.3	-179.5	0	0	0	0	0	114.8
163	E	39.4	Very low	53.6	Low	155 Å²	155	107.7 Å²	107.7	72%	0.724	68%	0.684	S	S	*	*	S	Bend	trans	-142.9	117.9	-179.6	-64.2	-167.4	143.5	0	0	112.6
164	Q	41.4	Very low	50.9	Low	191 Å²	191	110.4 Å²	110.4	89%	0.893	70%	0.696	S	S	*	*			trans	69.4	136	155.3	-53.6	168.7	24.6	0	0	116.2
165	G	34.6	Very low	48.7	Very low	73 Å²	73	114.7 Å²	114.7	75%	0.753	72%	0.721	S	S	*	*			cis	170	153.3	12.4	0	0	0	0	0	106.1
166	S	39.6	Very low	46.3	Very low	105 Å²	105	113.2 Å²	113.2	73%	0.734	74%	0.735	S	S	*	*			trans	-49.3	155.8	173.4	-157.5	0	0	0	0	112.5
167	D	33.5	Very low	43.9	Very low	154 Å²	154	114.1 Å²	114.1	82%	0.824	76%	0.755	S	S	*	*			trans	87.9	108.3	157.2	-49.9	-25.8	0	0	0	117.6
168	G	38.1	Very low	41.6	Very low	76 Å²	76	114.5 Å²	114.5	78%	0.784	77%	0.765	S	S	*	*			trans	-179.1	62.6	171.3	0	0	0	0	0	113	G170	G168-G170 PolarHBondContact O-N 3.47Å; G168-G170 VanDerWaalsContact O-N 3.16Å
169	I	38.3	Very low	39.9	Very low	182 Å²	182	118.4 Å²	118.4	93%	0.933	78%	0.781	S	S	*	*			trans	-56.9	112.7	162.1	-77	146.7	0	0	0	108
170	G	37.2	Very low	38.6	Very low	74 Å²	74	120.4 Å²	120.4	76%	0.763	79%	0.79	S	S	*	*			trans	-129.9	89.5	176.4	0	0	0	0	0	109.6	G168	G168-G170 PolarHBondContact O-N 3.47Å; G168-G170 VanDerWaalsContact O-N 3.16Å
171	D	34.9	Very low	38.1	Very low	153 Å²	153	125.7 Å²	125.7	82%	0.818	80%	0.798	S	S	*	*			trans	-53.7	124.9	164.8	174.1	21.2	0	0	0	111.3
172	S	47.4	Very low	37.8	Very low	110 Å²	110	130 Å²	130	77%	0.769	81%	0.812	S	S	*	*			trans	-159	106.1	140	81.9	0	0	0	0	111.6
173	S	40.9	Very low	37.4	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	82%	0.815	S	S	*	*			trans	56.9	107.4	133.1	-150.1	0	0	0	0	119.6	D175	S173-D175 PolarHBondContact O-N 3.22Å
174	Y	29.8	Very low	37.6	Very low	241 Å²	241	128.3 Å²	128.3	95%	0.945	81%	0.811	S	S	*	*			trans	-58	124.6	147.1	-93.8	-101.6	0	0	0	110.1
175	D	37.3	Very low	37.8	Very low	153 Å²	153	123.8 Å²	123.8	82%	0.818	82%	0.816	S	S	*	*			trans	-148.8	123	157.4	-167.9	36.6	0	0	0	104.4	S173	S173-D175 PolarHBondContact O-N 3.22Å
176	G	33.3	Very low	38.1	Very low	64 Å²	64	130 Å²	130	66%	0.66	82%	0.817	S	S	*	*			cis	115.6	56.4	30.2	0	0	0	0	0	109.7
177	G	30.9	Very low	38	Very low	84 Å²	84	131.9 Å²	131.9	87%	0.866	83%	0.829	S	S	*	*			trans	86.9	150.4	164.7	0	0	0	0	0	116.3
178	G	32.1	Very low	38.9	Very low	74 Å²	74	130.9 Å²	130.9	76%	0.763	82%	0.823	S	S	*	*			trans	140.2	92.7	172.3	0	0	0	0	0	112.4	S180	G178-S180 PolarHBondContact O-N 2.94Å
179	Q	34.4	Very low	39.5	Very low	196 Å²	196	131.9 Å²	131.9	92%	0.916	80%	0.803	S	S	*	*			trans	-47.5	123.4	167.2	-60.8	161.6	32.3	0	0	108.9
180	S	41.4	Very low	40.1	Very low	129 Å²	129	127.9 Å²	127.9	90%	0.902	79%	0.789	S	S	*	*			trans	-110.4	113	167.4	-149	0	0	0	0	108.5	G178	G178-S180 PolarHBondContact O-N 2.94Å
181	E	44.1	Very low	40.8	Very low	172 Å²	172	127 Å²	127	80%	0.804	76%	0.763	S	S	*	*			trans	-64	150.6	-166.3	-65.2	172.5	130.4	0	0	113.3	S183	E181-S183 PolarHBondContact O-N 2.87Å
182	V	40	Very low	41.6	Very low	152 Å²	152	126.8 Å²	126.8	92%	0.921	76%	0.757	S	S	*	*			trans	-44.7	101.7	157.6	175.9	0	0	0	0	110.1
183	S	37.1	Very low	41.7	Very low	118 Å²	118	127.3 Å²	127.3	83%	0.825	75%	0.747	S	S	*	*			trans	-158.4	73.3	161.1	-162.3	0	0	0	0	112.2	E181	E181-S183 PolarHBondContact O-N 2.87Å
184	S	43.7	Very low	41.9	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	75%	0.745	S	S	*	*	S	Bend	trans	-146.1	123.9	144.3	69.6	0	0	0	0	106.2	R186	S184-R186 PolarHBondContact O-N 2.76Å
185	G	44.6	Very low	42.5	Very low	96 Å²	96	128.5 Å²	128.5	99%	0.99	75%	0.746	S	S	*	*	S	Bend	trans	-65.1	58.7	-170	0	0	0	0	0	115.1
186	R	40.9	Very low	42.9	Very low	203 Å²	203	124.4 Å²	124.4	77%	0.766	74%	0.741	S	S	*	*			trans	-136.7	119.6	177.3	-69.2	-174.4	150.6	160.7	-4.6	107.5	S184 L188	S184-R186 PolarHBondContact O-N 2.76Å; R186-L188 HydrophobicContact CB-CD1 3.83Å; R186-L188 PolarHBondContact O-N 3.01Å
187	C	38.6	Very low	43.6	Very low	146 Å²	146	122.2 Å²	122.2	99%	0.986	72%	0.717	S	S	*	*			trans	-68.9	73.7	172.1	-56.8	0	0	0	0	109.6
188	L	51.8	Low	44.6	Very low	133 Å²	133	121.1 Å²	121.1	70%	0.696	70%	0.695	S	S	*	*			trans	-81.7	129.4	163.7	-93.1	93.8	0	0	0	108.4	R186 P190	R186-L188 HydrophobicContact CB-CD1 3.83Å; R186-L188 PolarHBondContact O-N 3.01Å; L188-P190 WeakPolarHBondContact O-CD 2.87Å
189	Y	50.2	Low	46	Very low	96 Å²	96	119.4 Å²	119.4	38%	0.376	68%	0.678	S	S	.	*			trans	-61.6	121.2	167.7	-172.9	-94.9	0	0	0	108.5	Y191 Y234 P280 D283	Y189-Y191 VanDerWaalsContact C-N 3.28Å; Y189-Y191 PolarHBondContact O-N 3.27Å; Y189-Y234 AromaticContact CE2-CD1 3.71Å; Y189-Y234 HydrophobicContact CE2-CD1 3.71Å; Y189-Y234 HydrophobicContact CE2-CD2 4.17Å; Y189-Y234 AromaticContact CE2-CE1 3.91Å; Y189-Y234 HydrophobicContact CE2-CE1 3.91Å; Y189-Y234 HydrophobicContact CE2-CE2 4.35Å; Y189-Y234 AromaticContact CE2-CG 3.82Å; Y189-Y234 HydrophobicContact CE2-CG 3.82Å; Y189-Y234 VanDerWaalsContact OH-CE2 3.24Å; Y189-Y234 WeakPolarHBondContact OH-CE2 3.12Å; Y189-P280 HydrophobicContact CD1-CG 4.39Å; Y189-P280 HydrophobicContact CE1-CG 3.56Å; Y189-D283 PolarHBondContact OH-OD2 3.13Å
190	P	50.5	Low	47.5	Very low	98 Å²	98	116 Å²	116	64%	0.636	66%	0.658	S	S	*	*			trans	-71.6	85	-179.7	29	-32.9	0	0	0	109.6	L188 H192	L188-P190 WeakPolarHBondContact O-CD 2.87Å; P190-H192 PolarHBondContact O-N 3.16Å; P190-H192 VanDerWaalsContact O-N 3.07Å
191	Y	52.4	Low	48.8	Very low	56 Å²	56	113 Å²	113	22%	0.22	63%	0.626	C	S	.	*			trans	-75	94.5	168.9	-169.1	-87.7	0	0	0	108.4	Y189 H193 A197 S198 P280	Y189-Y191 VanDerWaalsContact C-N 3.28Å; Y189-Y191 PolarHBondContact O-N 3.27Å; Y191-H193 AromaticContact CD1-CD2 3.68Å; Y191-H193 AromaticContact CD1-CG 3.98Å; Y191-H193 AromaticContact CD1-NE2 3.9Å; Y191-H193 AromaticContact CE1-CD2 3.77Å; Y191-H193 AromaticContact CE1-CE1 3.62Å; Y191-H193 AromaticContact CE1-CG 3.76Å; Y191-H193 AromaticContact CE1-ND1 3.67Å; Y191-H193 AromaticContact CE1-NE2 3.71Å; Y191-H193 PolarHBondContact O-N 3.17Å; Y191-H193 VanDerWaalsContact O-N 3.12Å; Y191-A197 HydrophobicContact CE1-CB 4.35Å; Y191-S198 PolarHBondContact OH-O 3.43Å; Y191-P280 HydrophobicContact CD2-CB 3.94Å; Y191-P280 HydrophobicContact CD2-CG 3.9Å; Y191-P280 HydrophobicContact CE2-CB 3.63Å; Y191-P280 HydrophobicContact CE2-CG 4.04Å
192	H	51.4	Low	50.4	Low	148 Å²	148	109.5 Å²	109.5	69%	0.685	61%	0.609	S	S	*	*			trans	-70.2	104.5	168.9	-86.8	-84.7	0	0	0	108.3	P190 Q194	P190-H192 PolarHBondContact O-N 3.16Å; P190-H192 VanDerWaalsContact O-N 3.07Å; H192-Q194 PolarHBondContact O-N 3.45Å
193	H	50.4	Low	52.2	Low	122 Å²	122	102.5 Å²	102.5	57%	0.565	57%	0.567	S	S	*	*			trans	-64.9	78.4	162.3	-91.9	-75.4	0	0	0	108.7	Y191	Y191-H193 AromaticContact CD1-CD2 3.68Å; Y191-H193 AromaticContact CD1-CG 3.98Å; Y191-H193 AromaticContact CD1-NE2 3.9Å; Y191-H193 AromaticContact CE1-CD2 3.77Å; Y191-H193 AromaticContact CE1-CE1 3.62Å; Y191-H193 AromaticContact CE1-CG 3.76Å; Y191-H193 AromaticContact CE1-ND1 3.67Å; Y191-H193 AromaticContact CE1-NE2 3.71Å; Y191-H193 PolarHBondContact O-N 3.17Å; Y191-H193 VanDerWaalsContact O-N 3.12Å
194	Q	45.4	Very low	54.3	Low	141 Å²	141	97.7 Å²	97.7	66%	0.659	53%	0.532	S	S	*	.			trans	-66.3	138.1	157.5	-68	-163.3	-8.4	0	0	107.2	H192 G196 A197	H192-Q194 PolarHBondContact O-N 3.45Å; Q194-G196 VanDerWaalsContact C-N 3.33Å; Q194-G196 PolarHBondContact O-N 3.08Å; Q194-A197 WeakPolarHBondContact O-CB 3.11Å; Q194-A197 PolarHBondContact O-N 3.47Å
195	K	40.8	Very low	56	Low	225 Å²	225	93.4 Å²	93.4	98%	0.978	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	95.3	177.3	-158.5	179.5	-173.2	-176	0	107.2
196	G	46.4	Very low	57.7	Low	68 Å²	68	92.2 Å²	92.2	70%	0.701	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.7	-11.9	-166.7	0	0	0	0	0	114.2	Q194 S198	Q194-G196 VanDerWaalsContact C-N 3.33Å; Q194-G196 PolarHBondContact O-N 3.08Å; G196-S198 PolarHBondContact O-N 2.78Å
197	A	48.9	Very low	59.3	Low	18 Å²	18	84.6 Å²	84.6	15%	0.149	46%	0.455	C	S	.	.			trans	-61.4	88	176.6	0	0	0	0	0	113	Y191 Q194 D282	Y191-A197 HydrophobicContact CE1-CB 4.35Å; Q194-A197 WeakPolarHBondContact O-CB 3.11Å; Q194-A197 PolarHBondContact O-N 3.47Å; A197-D282 WeakPolarHBondContact CA-OD1 3.1Å; A197-D282 WeakPolarHBondContact CA-OD2 3.41Å; A197-D282 WeakPolarHBondContact CB-OD2 3.41Å
198	S	50.4	Low	60.8	Low	60 Å²	60	80.9 Å²	80.9	42%	0.42	43%	0.425	S	S	.	.			trans	-57.7	141.1	173.1	27	0	0	0	0	109.5	Y191 G196 V281	Y191-S198 PolarHBondContact OH-O 3.43Å; G196-S198 PolarHBondContact O-N 2.78Å; S198-V281 VanDerWaalsContact C-CG2 3.42Å; S198-V281 WeakPolarHBondContact O-CB 3.15Å; S198-V281 WeakPolarHBondContact O-CG2 3.16Å; S198-V281 PolarHBondContact O-N 2.75Å; S198-V281 VanDerWaalsContact OG-CB 3.23Å; S198-V281 WeakPolarHBondContact OG-CB 3.43Å; S198-V281 WeakPolarHBondContact OG-CG1 3.16Å
199	G	62	Low	61.5	Low	39 Å²	39	74.5 Å²	74.5	40%	0.402	39%	0.392	S	S	.	.			trans	-63.7	-128.5	-159.2	0	0	0	0	0	118.6	V281	G199-V281 WeakPolarHBondContact O-CG2 3.5Å; G199-V281 PolarHBondContact O-N 2.75Å; G199-V281 VanDerWaalsContact O-N 3.17Å
200	Y	66.8	Low	62.9	Low	123 Å²	123	72.7 Å²	72.7	48%	0.482	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.1	179.2	-63.7	-81.5	0	0	0	110.2	F202 A278 Q279	Y200-F202 WeakPolarHBondContact O-CE2 3.42Å; Y200-A278 HydrophobicContact CD1-CB 3.82Å; Y200-A278 HydrophobicContact CG-CB 4.36Å; Y200-Q279 CarbonylContact C-O 3.45Å
201	R	68.8	Low	64.4	Low	66 Å²	66	68.6 Å²	68.6	25%	0.249	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	140.2	163.6	-62.8	-173.5	176.8	120.4	-6.6	109.2	L214 A278 Q279 V281	R201-L214 HydrophobicContact CB-CB 4.31Å; R201-L214 HydrophobicContact CB-CD2 3.98Å; R201-A278 CarbonylContact O-C 3.53Å; R201-A278 VanDerWaalsContact O-CA 3.25Å; R201-A278 WeakPolarHBondContact O-CA 3.29Å; R201-Q279 PolarHBondContact N-O 3.33Å; R201-Q279 PolarHBondContact O-N 2.83Å; R201-V281 HydrophobicContact CG-CG2 3.7Å; R201-V281 PolarHBondContact NH1-O 3.02Å; R201-V281 VanDerWaalsContact NH2-CG1 3.29Å; R201-V281 PolarHBondContact NH2-O 3.47Å
202	F	76.2	Confident	65.7	Low	99 Å²	99	70.9 Å²	70.9	43%	0.434	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.5	-179.4	-61.7	-90.2	0	0	0	110.3	Y200 V277	Y200-F202 WeakPolarHBondContact O-CE2 3.42Å; F202-V277 WeakPolarHBondContact CA-O 3.4Å
203	C	77.9	Confident	67	Low	6 Å²	6	64.6 Å²	64.6	4%	0.041	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.2	165.7	-172.2	0	0	0	0	109.6	R212 L214 V277	C203-R212 VanDerWaalsContact CA-O 3.23Å; C203-R212 WeakPolarHBondContact CA-O 3.41Å; C203-R212 PolarHBondContact SG-O 3.29Å; C203-L214 HydrophobicContact CB-CD2 3.74Å; C203-L214 HydrophobicContact CB-CG 3.94Å; C203-V277 HydrophobicContact CB-CB 4.33Å; C203-V277 PolarHBondContact N-O 3.42Å; C203-V277 VanDerWaalsContact N-O 3.14Å; C203-V277 PolarHBondContact O-N 2.87Å
204	T	81.2	Confident	68.2	Low	16 Å²	16	60 Å²	60	10%	0.098	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	141.3	178.6	-52	0	0	0	0	110	F206 I211 R212 C275	T204-F206 HydrophobicContact CG2-CD1 4.15Å; T204-I211 CarbonylContact O-C 3.58Å; T204-I211 WeakPolarHBondContact O-CA 3.13Å; T204-R212 PolarHBondContact N-O 3.25Å; T204-R212 PolarHBondContact O-N 3Å; T204-C275 WeakPolarHBondContact CA-O 3.41Å
205	V	80.5	Confident	69.6	Low	2 Å²	2	59 Å²	59	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.4	171.6	-170.6	0	0	0	0	108.9	P209 H210 I211 W227 L229 I253	V205-P209 HydrophobicContact CG1-CB 3.74Å; V205-H210 CarbonylContact C-O 3.54Å; V205-H210 VanDerWaalsContact CA-O 3.3Å; V205-H210 WeakPolarHBondContact CA-O 3.23Å; V205-I211 HydrophobicContact CG1-CG1 4.07Å; V205-I211 HydrophobicContact CG2-CD1 4.46Å; V205-I211 HydrophobicContact CG2-CG1 4.05Å; V205-I211 HydrophobicContact CG2-CG2 4.31Å; V205-W227 HydrophobicContact CG1-CH2 4.35Å; V205-W227 HydrophobicContact CG1-CZ2 4.37Å; V205-W227 HydrophobicContact CG2-CH2 4.08Å; V205-L229 HydrophobicContact CG2-CD1 3.27Å; V205-L229 HydrophobicContact CG2-CD2 3.47Å; V205-L229 VanDerWaalsContact CG2-CD2 3.47Å; V205-L229 HydrophobicContact CG2-CG 4Å; V205-I253 HydrophobicContact CB-CD1 3.85Å; V205-I253 HydrophobicContact CG1-CD1 3.38Å; V205-I253 HydrophobicContact CG1-CG1 4.22Å
206	F	80.6	Confident	71	Confident	71 Å²	71	49.7 Å²	49.7	31%	0.311	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159.4	178.8	57.8	-83.9	0	0	0	111.8	T204 H210 P272	T204-F206 HydrophobicContact CG2-CD1 4.15Å; F206-H210 HydrophobicContact CD1-CB 4.27Å; F206-H210 WeakPolarHBondContact CD1-O 3.42Å; F206-H210 HydrophobicContact CD2-CB 3.89Å; F206-H210 HydrophobicContact CE1-CB 3.9Å; F206-H210 HydrophobicContact CE2-CB 3.48Å; F206-H210 VanDerWaalsContact CE2-CB 3.48Å; F206-H210 AromaticContact CE2-CD2 3.73Å; F206-H210 AromaticContact CE2-CG 3.93Å; F206-H210 HydrophobicContact CG-CB 4.27Å; F206-H210 HydrophobicContact CZ-CB 3.49Å; F206-H210 VanDerWaalsContact CZ-CB 3.49Å; F206-H210 PolarHBondContact N-O 2.9Å; F206-H210 PolarHBondContact O-N 3.01Å; F206-P272 HydrophobicContact CB-CB 4.11Å
207	G	75.1	Confident	72.4	Confident	43 Å²	43	52.1 Å²	52.1	44%	0.443	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	-138.7	173.6	0	0	0	0	0	114.4
208	D	69	Low	74.1	Confident	68 Å²	68	57.7 Å²	57.7	36%	0.364	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	95.8	170.1	55.2	-46.6	0	0	0	110.5	H210 S251	D208-H210 VanDerWaalsContact C-N 3.26Å; D208-H210 PolarHBondContact O-N 3.43Å; D208-H210 IonicContact OD1-CD2 3.69Å; D208-H210 IonicContact OD1-CE1 2.87Å; D208-H210 IonicContact OD1-NE2 2.94Å; D208-H210 PolarHBondContact OD1-NE2 3.32Å; D208-H210 VanDerWaalsContact OD1-NE2 3.15Å; D208-S251 WeakPolarHBondContact CA-O 3.45Å
209	P	66.5	Low	75.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn		-43.5	93.4	-125.3	27.4	-39	0	0	0	111.7	V205 I211 C221 N241 S251	V205-P209 HydrophobicContact CG1-CB 3.74Å; P209-I211 PolarHBondContact O-N 2.9Å; P209-C221 WeakPolarHBondContact CD-O 3.38Å; P209-C221 HydrophobicContact CG-CB 3.94Å; P209-C221 WeakPolarHBondContact CG-O 3.07Å; P209-C221 PolarHBondContact O-N 3.46Å; P209-N241 WeakPolarHBondContact CG-ND2 3.18Å; P209-S251 VanDerWaalsContact CD-O 3.29Å; P209-S251 WeakPolarHBondContact CD-O 3.31Å; P209-S251 WeakPolarHBondContact CD-OG 3.22Å
210	H	80.1	Confident	76.6	Confident	58 Å²	58	59.4 Å²	59.4	27%	0.269	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.2	165.3	-65.6	-55.5	0	0	0	106.9	V205 F206 D208 E219 T220	V205-H210 CarbonylContact C-O 3.54Å; V205-H210 VanDerWaalsContact CA-O 3.3Å; V205-H210 WeakPolarHBondContact CA-O 3.23Å; F206-H210 HydrophobicContact CD1-CB 4.27Å; F206-H210 WeakPolarHBondContact CD1-O 3.42Å; F206-H210 HydrophobicContact CD2-CB 3.89Å; F206-H210 HydrophobicContact CE1-CB 3.9Å; F206-H210 HydrophobicContact CE2-CB 3.48Å; F206-H210 VanDerWaalsContact CE2-CB 3.48Å; F206-H210 AromaticContact CE2-CD2 3.73Å; F206-H210 AromaticContact CE2-CG 3.93Å; F206-H210 HydrophobicContact CG-CB 4.27Å; F206-H210 HydrophobicContact CZ-CB 3.49Å; F206-H210 VanDerWaalsContact CZ-CB 3.49Å; F206-H210 PolarHBondContact N-O 2.9Å; F206-H210 PolarHBondContact O-N 3.01Å; D208-H210 VanDerWaalsContact C-N 3.26Å; D208-H210 PolarHBondContact O-N 3.43Å; D208-H210 IonicContact OD1-CD2 3.69Å; D208-H210 IonicContact OD1-CE1 2.87Å; D208-H210 IonicContact OD1-NE2 2.94Å; D208-H210 PolarHBondContact OD1-NE2 3.32Å; D208-H210 VanDerWaalsContact OD1-NE2 3.15Å; H210-E219 CarbonylContact C-O 3.38Å; H210-E219 VanDerWaalsContact CA-O 3.27Å; H210-E219 WeakPolarHBondContact CA-O 3.39Å; H210-T220 PolarHBondContact CE1-OG1 3.4Å; H210-T220 PolarHBondContact ND1-OG1 3.46Å
211	I	81.7	Confident	77.1	Confident	11 Å²	11	54 Å²	54	6%	0.056	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.7	-178.1	-53.8	-173.4	0	0	0	108.2	T204 V205 P209 T213 H218 E219 C221 W227 L229	T204-I211 CarbonylContact O-C 3.58Å; T204-I211 WeakPolarHBondContact O-CA 3.13Å; V205-I211 HydrophobicContact CG1-CG1 4.07Å; V205-I211 HydrophobicContact CG2-CD1 4.46Å; V205-I211 HydrophobicContact CG2-CG1 4.05Å; V205-I211 HydrophobicContact CG2-CG2 4.31Å; P209-I211 PolarHBondContact O-N 2.9Å; I211-T213 HydrophobicContact CG2-CG2 4.42Å; I211-H218 CarbonylContact O-C 3.55Å; I211-H218 VanDerWaalsContact O-CA 3.29Å; I211-H218 WeakPolarHBondContact O-CA 3.29Å; I211-E219 PolarHBondContact N-O 3.01Å; I211-E219 PolarHBondContact O-N 3.12Å; I211-C221 HydrophobicContact CD1-CB 4.46Å; I211-C221 WeakPolarHBondContact CD1-SG 3.3Å; I211-W227 HydrophobicContact CD1-CH2 3.42Å; I211-W227 VanDerWaalsContact CD1-CH2 3.42Å; I211-W227 HydrophobicContact CD1-CZ2 4.38Å; I211-W227 HydrophobicContact CD1-CZ3 3.81Å; I211-W227 HydrophobicContact CG1-CH2 4.34Å; I211-L229 HydrophobicContact CG2-CD1 4.45Å
212	R	80.1	Confident	77.6	Confident	105 Å²	105	55.4 Å²	55.4	40%	0.396	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.3	157.9	-172	176.7	-179.1	-149.5	0.3	107.8	C203 T204 Q217	C203-R212 VanDerWaalsContact CA-O 3.23Å; C203-R212 WeakPolarHBondContact CA-O 3.41Å; C203-R212 PolarHBondContact SG-O 3.29Å; T204-R212 PolarHBondContact N-O 3.25Å; T204-R212 PolarHBondContact O-N 3Å; R212-Q217 CarbonylContact C-O 3.58Å; R212-Q217 VanDerWaalsContact CA-O 3.29Å; R212-Q217 WeakPolarHBondContact CA-O 3.33Å
213	T	78.8	Confident	77.7	Confident	16 Å²	16	52 Å²	52	10%	0.098	28%	0.278	C	S	.	.			trans	-69.8	164.8	-179.5	70.3	0	0	0	0	111.2	I211 N215 G216 Q217 E219	I211-T213 HydrophobicContact CG2-CG2 4.42Å; T213-N215 PolarHBondContact O-N 3.41Å; T213-N215 VanDerWaalsContact O-N 3.11Å; T213-N215 PolarHBondContact OG1-N 2.83Å; T213-G216 WeakPolarHBondContact O-CA 3.3Å; T213-G216 PolarHBondContact O-N 3.47Å; T213-Q217 HydrophobicContact CG2-CB 4.31Å; T213-Q217 PolarHBondContact N-O 2.82Å; T213-Q217 WeakPolarHBondContact OG1-CB 3.29Å; T213-Q217 PolarHBondContact OG1-N 3.49Å; T213-Q217 VanDerWaalsContact OG1-N 3.13Å; T213-Q217 PolarHBondContact OG1-O 2.94Å; T213-E219 WeakPolarHBondContact CG2-OE2 3.32Å
214	L	76	Confident	77.8	Confident	24 Å²	24	55.3 Å²	55.3	13%	0.126	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.1	174.8	-67	160.6	0	0	0	113.5	R201 C203 G216 L230 Q279 M295	R201-L214 HydrophobicContact CB-CB 4.31Å; R201-L214 HydrophobicContact CB-CD2 3.98Å; C203-L214 HydrophobicContact CB-CD2 3.74Å; C203-L214 HydrophobicContact CB-CG 3.94Å; L214-G216 VanDerWaalsContact C-N 3.27Å; L214-L230 HydrophobicContact CD1-CD1 3.98Å; L214-Q279 HydrophobicContact CD2-CB 4.4Å; L214-Q279 HydrophobicContact CD2-CG 4.37Å; L214-M295 HydrophobicContact CD1-CE 3.28Å
215	N	73	Confident	77.9	Confident	122 Å²	122	56.1 Å²	56.1	65%	0.652	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	4.1	174.8	-64.3	-19.8	0	0	0	112.5	T213 Q217	T213-N215 PolarHBondContact O-N 3.41Å; T213-N215 VanDerWaalsContact O-N 3.11Å; T213-N215 PolarHBondContact OG1-N 2.83Å; N215-Q217 VanDerWaalsContact C-N 3.31Å; N215-Q217 PolarHBondContact O-N 3.2Å
216	G	71.7	Confident	78	Confident	29 Å²	29	59 Å²	59	30%	0.299	33%	0.331	S	S	.	.	S	Bend	trans	77.7	8.1	-179.6	0	0	0	0	0	115.1	T213 L214	T213-G216 WeakPolarHBondContact O-CA 3.3Å; T213-G216 PolarHBondContact O-N 3.47Å; L214-G216 VanDerWaalsContact C-N 3.27Å
217	Q	75.2	Confident	78	Confident	119 Å²	119	57.1 Å²	57.1	56%	0.556	32%	0.322	S	S	*	.			trans	-76.4	146.8	175.2	-58.6	-58	-57.3	0	0	110.4	R212 T213 N215	R212-Q217 CarbonylContact C-O 3.58Å; R212-Q217 VanDerWaalsContact CA-O 3.29Å; R212-Q217 WeakPolarHBondContact CA-O 3.33Å; T213-Q217 HydrophobicContact CG2-CB 4.31Å; T213-Q217 PolarHBondContact N-O 2.82Å; T213-Q217 WeakPolarHBondContact OG1-CB 3.29Å; T213-Q217 PolarHBondContact OG1-N 3.49Å; T213-Q217 VanDerWaalsContact OG1-N 3.13Å; T213-Q217 PolarHBondContact OG1-O 2.94Å; N215-Q217 VanDerWaalsContact C-N 3.31Å; N215-Q217 PolarHBondContact O-N 3.2Å
218	H	84.6	Confident	78.2	Confident	135 Å²	135	58 Å²	58	63%	0.625	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.3	175.8	-64	81.2	0	0	0	109.4	I211	I211-H218 CarbonylContact O-C 3.55Å; I211-H218 VanDerWaalsContact O-CA 3.29Å; I211-H218 WeakPolarHBondContact O-CA 3.29Å
219	E	82.8	Confident	78.8	Confident	43 Å²	43	56 Å²	56	20%	0.201	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	155.4	-179.4	-72.1	150.8	-173.1	0	0	109.5	H210 I211 T213 A297	H210-E219 CarbonylContact C-O 3.38Å; H210-E219 VanDerWaalsContact CA-O 3.27Å; H210-E219 WeakPolarHBondContact CA-O 3.39Å; I211-E219 PolarHBondContact N-O 3.01Å; I211-E219 PolarHBondContact O-N 3.12Å; T213-E219 WeakPolarHBondContact CG2-OE2 3.32Å; E219-A297 VanDerWaalsContact CD-CB 3.42Å; E219-A297 WeakPolarHBondContact OE1-CB 3.38Å; E219-A297 WeakPolarHBondContact OE2-CA 3.41Å
220	T	82.5	Confident	79.5	Confident	92 Å²	92	56.3 Å²	56.3	56%	0.564	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.8	174.1	-55.4	0	0	0	0	107.5	H210	H210-T220 PolarHBondContact CE1-OG1 3.4Å; H210-T220 PolarHBondContact ND1-OG1 3.46Å
221	C	76.1	Confident	79.4	Confident	9 Å²	9	57 Å²	57	6%	0.061	32%	0.316	C	S	.	.			trans	-109.9	150.4	-170.7	-53.3	0	0	0	0	112.5	P209 I211 T223 C298	P209-C221 WeakPolarHBondContact CD-O 3.38Å; P209-C221 HydrophobicContact CG-CB 3.94Å; P209-C221 WeakPolarHBondContact CG-O 3.07Å; P209-C221 PolarHBondContact O-N 3.46Å; I211-C221 HydrophobicContact CD1-CB 4.46Å; I211-C221 WeakPolarHBondContact CD1-SG 3.3Å; C221-T223 HydrophobicContact CB-CG2 4.26Å; C221-C298 HydrophobicContact CB-CB 3.5Å; C221-C298 VanDerWaalsContact CB-CB 3.5Å; C221-C298 WeakPolarHBondContact CB-SG 3.18Å; C221-C298 WeakPolarHBondContact SG-CB 3.24Å; C221-C298 CovalentContact SG-SG 2Å; C221-C298 PolarHBondContact SG-SG 3Å
222	L	80.4	Confident	78.9	Confident	95 Å²	95	57.3 Å²	57.3	50%	0.497	32%	0.318	S	S	.	.			trans	-111.2	92.7	161.3	179.9	68.2	0	0	0	107.8	E248	L222-E248 WeakPolarHBondContact CD1-O 3.26Å; L222-E248 WeakPolarHBondContact CD2-O 3.48Å
223	T	77.2	Confident	78.6	Confident	27 Å²	27	56.9 Å²	56.9	17%	0.166	33%	0.331	C	S	.	.			trans	-115.9	132.1	174.3	51	0	0	0	0	108.2	C221 W227 N241 S251	C221-T223 HydrophobicContact CB-CG2 4.26Å; T223-W227 HydrophobicContact CG2-CG 4.47Å; T223-W227 PolarHBondContact OG1-NE1 3.33Å; T223-W227 VanDerWaalsContact OG1-NE1 3.1Å; T223-N241 WeakPolarHBondContact O-CB 3.26Å; T223-N241 PolarHBondContact O-ND2 3.11Å; T223-N241 PolarHBondContact OG1-ND2 2.82Å; T223-S251 VanDerWaalsContact O-CB 3.3Å; T223-S251 WeakPolarHBondContact O-CB 3.47Å; T223-S251 PolarHBondContact O-OG 3.35Å; T223-S251 VanDerWaalsContact O-OG 3.07Å
224	L	81	Confident	78.2	Confident	77 Å²	77	62.1 Å²	62.1	40%	0.403	35%	0.35	S	S	.	.			trans	-113.4	146.1	175.9	-67.2	177.3	0	0	0	109.4	P243 E248	L224-P243 HydrophobicContact CD2-CB 4.47Å; L224-P243 HydrophobicContact CD2-CG 3.82Å; L224-E248 HydrophobicContact CD1-CB 4.44Å; L224-E248 HydrophobicContact CD1-CG 4.37Å
225	G	82.4	Confident	78.2	Confident	33 Å²	33	64.5 Å²	64.5	34%	0.34	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	72.3	-158.6	-176.4	0	0	0	0	0	112.7	T240 N241	G225-T240 CarbonylContact O-C 3.59Å; G225-T240 VanDerWaalsContact O-CA 3.31Å; G225-T240 WeakPolarHBondContact O-CA 3.15Å; G225-N241 PolarHBondContact N-O 2.97Å; G225-N241 PolarHBondContact O-N 2.87Å
226	A	83.6	Confident	78.5	Confident	63 Å²	63	62.2 Å²	62.2	52%	0.521	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.2	-177.4	0	0	0	0	0	112.1	Q238 A239	A226-Q238 HydrophobicContact CB-CG 4.33Å; A226-A239 CarbonylContact C-O 3.59Å; A226-A239 WeakPolarHBondContact CA-O 3.29Å
227	W	80.6	Confident	79.1	Confident	31 Å²	31	62.5 Å²	62.5	12%	0.117	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	146.1	178.8	58.3	-83	0	0	0	111.5	V205 I211 T223 L229 Q238 A239 N241	V205-W227 HydrophobicContact CG1-CH2 4.35Å; V205-W227 HydrophobicContact CG1-CZ2 4.37Å; V205-W227 HydrophobicContact CG2-CH2 4.08Å; I211-W227 HydrophobicContact CD1-CH2 3.42Å; I211-W227 VanDerWaalsContact CD1-CH2 3.42Å; I211-W227 HydrophobicContact CD1-CZ2 4.38Å; I211-W227 HydrophobicContact CD1-CZ3 3.81Å; I211-W227 HydrophobicContact CG1-CH2 4.34Å; T223-W227 HydrophobicContact CG2-CG 4.47Å; T223-W227 PolarHBondContact OG1-NE1 3.33Å; T223-W227 VanDerWaalsContact OG1-NE1 3.1Å; W227-L229 HydrophobicContact CH2-CB 4.4Å; W227-L229 HydrophobicContact CH2-CD1 3.77Å; W227-L229 HydrophobicContact CZ3-CB 4.01Å; W227-L229 HydrophobicContact CZ3-CD1 3.68Å; W227-L229 HydrophobicContact CZ3-CG 4.48Å; W227-L229 PolarHBondContact O-N 3.15Å; W227-Q238 WeakPolarHBondContact O-CA 3.44Å; W227-Q238 VanDerWaalsContact O-CG 3.31Å; W227-Q238 WeakPolarHBondContact O-CG 3.17Å; W227-A239 HydrophobicContact CD2-CB 4.26Å; W227-A239 HydrophobicContact CH2-CB 4.26Å; W227-A239 HydrophobicContact CZ2-CB 3.58Å; W227-A239 PolarHBondContact N-O 3.36Å; W227-A239 PolarHBondContact O-N 2.92Å; W227-N241 PolarHBondContact NE1-ND2 2.81Å; W227-N241 PolarHBondContact NE1-OD1 2.86Å
228	P	79.9	Confident	79.6	Confident	62 Å²	62	63.4 Å²	63.4	40%	0.403	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.6	179.6	30.3	-32.6	0	0	0	110.1	D231	P228-D231 HydrophobicContact CB-CB 4.49Å
229	L	80.8	Confident	79.5	Confident	26 Å²	26	57.5 Å²	57.5	14%	0.136	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-38.1	170.3	177.9	58.8	0	0	0	111.1	V205 I211 W227 V237	V205-L229 HydrophobicContact CG2-CD1 3.27Å; V205-L229 HydrophobicContact CG2-CD2 3.47Å; V205-L229 VanDerWaalsContact CG2-CD2 3.47Å; V205-L229 HydrophobicContact CG2-CG 4Å; I211-L229 HydrophobicContact CG2-CD1 4.45Å; W227-L229 HydrophobicContact CH2-CB 4.4Å; W227-L229 HydrophobicContact CH2-CD1 3.77Å; W227-L229 HydrophobicContact CZ3-CB 4.01Å; W227-L229 HydrophobicContact CZ3-CD1 3.68Å; W227-L229 HydrophobicContact CZ3-CG 4.48Å; W227-L229 PolarHBondContact O-N 3.15Å; L229-V237 HydrophobicContact CB-CB 4.33Å; L229-V237 HydrophobicContact CB-CG1 4.15Å; L229-V237 HydrophobicContact CD2-CG1 3.99Å; L229-V237 PolarHBondContact N-O 2.97Å
230	L	80.6	Confident	79.5	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	133	173.3	179.6	61.8	0	0	0	108.7	L214 N232 F235 A236 V237 V277 Q279 M295	L214-L230 HydrophobicContact CD1-CD1 3.98Å; L230-N232 WeakPolarHBondContact CD2-ND2 3.47Å; L230-F235 HydrophobicContact CD2-CD2 4.03Å; L230-F235 HydrophobicContact CD2-CE1 4.37Å; L230-F235 HydrophobicContact CD2-CE2 3.17Å; L230-F235 HydrophobicContact CD2-CZ 3.36Å; L230-F235 HydrophobicContact CG-CE2 4.23Å; L230-A236 CarbonylContact O-C 3.57Å; L230-A236 VanDerWaalsContact O-CA 3.26Å; L230-A236 WeakPolarHBondContact O-CA 3.4Å; L230-V237 HydrophobicContact CB-CB 4.28Å; L230-V237 HydrophobicContact CB-CG2 4.39Å; L230-V237 PolarHBondContact N-O 3.24Å; L230-V237 VanDerWaalsContact N-O 3.11Å; L230-V237 PolarHBondContact O-N 2.76Å; L230-V277 HydrophobicContact CD2-CG1 3.5Å; L230-V277 VanDerWaalsContact CD2-CG1 3.5Å; L230-Q279 HydrophobicContact CD2-CG 4.07Å; L230-M295 HydrophobicContact CD1-CE 4.19Å; L230-M295 HydrophobicContact CD1-CG 4.38Å
231	D	79.3	Confident	79.4	Confident	71 Å²	71	52.4 Å²	52.4	38%	0.38	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	107.5	173.2	-169.6	-1.9	0	0	0	107.4	P228	P228-D231 HydrophobicContact CB-CB 4.49Å
232	N	70.9	Confident	79.7	Confident	18 Å²	18	54.9 Å²	54.9	10%	0.096	32%	0.315	C	S	.	.			trans	-133.6	175.7	179.9	70.2	52.9	0	0	0	110.7	L230 Y234 F235 Q279 P286	L230-N232 WeakPolarHBondContact CD2-ND2 3.47Å; N232-Y234 PolarHBondContact O-N 3.48Å; N232-Y234 WeakPolarHBondContact OD1-CA 3.48Å; N232-Y234 VanDerWaalsContact OD1-CB 3.31Å; N232-Y234 WeakPolarHBondContact OD1-CB 3.49Å; N232-Y234 PolarHBondContact OD1-N 3.15Å; N232-F235 PolarHBondContact N-O 2.85Å; N232-F235 VanDerWaalsContact N-O 3.12Å; N232-F235 WeakPolarHBondContact ND2-CE1 3.35Å; N232-F235 PolarHBondContact OD1-N 2.71Å; N232-F235 PolarHBondContact OD1-O 3.06Å; N232-Q279 PolarHBondContact ND2-NE2 2.92Å; N232-P286 HydrophobicContact CB-CG 4.41Å
233	S	72.6	Confident	79.6	Confident	96 Å²	96	53 Å²	53	67%	0.671	31%	0.308	S	S	*	.	S	Bend	trans	-61.4	-12.5	-178.3	46.6	0	0	0	0	115.3
234	Y	70.3	Confident	79.3	Confident	126 Å²	126	54 Å²	54	49%	0.494	32%	0.319	S	S	.	.	S	Bend	trans	-114.2	-35.6	-172.5	-51.3	-72	0	0	0	112.9	Y189 N232 D283	Y189-Y234 AromaticContact CE2-CD1 3.71Å; Y189-Y234 HydrophobicContact CE2-CD1 3.71Å; Y189-Y234 HydrophobicContact CE2-CD2 4.17Å; Y189-Y234 AromaticContact CE2-CE1 3.91Å; Y189-Y234 HydrophobicContact CE2-CE1 3.91Å; Y189-Y234 HydrophobicContact CE2-CE2 4.35Å; Y189-Y234 AromaticContact CE2-CG 3.82Å; Y189-Y234 HydrophobicContact CE2-CG 3.82Å; Y189-Y234 VanDerWaalsContact OH-CE2 3.24Å; Y189-Y234 WeakPolarHBondContact OH-CE2 3.12Å; N232-Y234 PolarHBondContact O-N 3.48Å; N232-Y234 WeakPolarHBondContact OD1-CA 3.48Å; N232-Y234 VanDerWaalsContact OD1-CB 3.31Å; N232-Y234 WeakPolarHBondContact OD1-CB 3.49Å; N232-Y234 PolarHBondContact OD1-N 3.15Å; Y234-D283 PolarHBondContact OH-OD1 2.95Å
235	F	76.5	Confident	78.8	Confident	74 Å²	74	52.6 Å²	52.6	33%	0.325	32%	0.323	S	S	.	.			trans	-158.9	151.3	179.1	63.1	-82.6	0	0	0	112.1	L230 N232 V237 V277 Q279	L230-F235 HydrophobicContact CD2-CD2 4.03Å; L230-F235 HydrophobicContact CD2-CE1 4.37Å; L230-F235 HydrophobicContact CD2-CE2 3.17Å; L230-F235 HydrophobicContact CD2-CZ 3.36Å; L230-F235 HydrophobicContact CG-CE2 4.23Å; N232-F235 PolarHBondContact N-O 2.85Å; N232-F235 VanDerWaalsContact N-O 3.12Å; N232-F235 WeakPolarHBondContact ND2-CE1 3.35Å; N232-F235 PolarHBondContact OD1-N 2.71Å; N232-F235 PolarHBondContact OD1-O 3.06Å; F235-V237 HydrophobicContact CD2-CG2 3.88Å; F235-V237 HydrophobicContact CE2-CG2 4.11Å; F235-V277 HydrophobicContact CE2-CG1 3.37Å; F235-V277 HydrophobicContact CE2-CG2 4.45Å; F235-V277 HydrophobicContact CZ-CG1 3.48Å; F235-V277 VanDerWaalsContact CZ-CG1 3.48Å; F235-Q279 HydrophobicContact CE1-CG 4.04Å; F235-Q279 HydrophobicContact CZ-CG 3.62Å
236	A	80.6	Confident	78.1	Confident	75 Å²	75	59.5 Å²	59.5	62%	0.62	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.6	174.5	0	0	0	0	0	109.9	L230	L230-A236 CarbonylContact O-C 3.57Å; L230-A236 VanDerWaalsContact O-CA 3.26Å; L230-A236 WeakPolarHBondContact O-CA 3.4Å
237	V	83.3	Confident	76.9	Confident	35 Å²	35	60.5 Å²	60.5	21%	0.212	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.6	176.3	-174	0	0	0	0	107.3	L229 L230 F235 V277	L229-V237 HydrophobicContact CB-CB 4.33Å; L229-V237 HydrophobicContact CB-CG1 4.15Å; L229-V237 HydrophobicContact CD2-CG1 3.99Å; L229-V237 PolarHBondContact N-O 2.97Å; L230-V237 HydrophobicContact CB-CB 4.28Å; L230-V237 HydrophobicContact CB-CG2 4.39Å; L230-V237 PolarHBondContact N-O 3.24Å; L230-V237 VanDerWaalsContact N-O 3.11Å; L230-V237 PolarHBondContact O-N 2.76Å; F235-V237 HydrophobicContact CD2-CG2 3.88Å; F235-V237 HydrophobicContact CE2-CG2 4.11Å; V237-V277 HydrophobicContact CG2-CG2 3.96Å
238	Q	86.4	Confident	76.4	Confident	137 Å²	137	65.9 Å²	65.9	64%	0.64	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.8	178	-169.2	178.3	-73.7	0	0	109.1	A226 W227	A226-Q238 HydrophobicContact CB-CG 4.33Å; W227-Q238 WeakPolarHBondContact O-CA 3.44Å; W227-Q238 VanDerWaalsContact O-CG 3.31Å; W227-Q238 WeakPolarHBondContact O-CG 3.17Å
239	A	81.6	Confident	75.8	Confident	11 Å²	11	67.2 Å²	67.2	9%	0.091	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	150.9	170.2	0	0	0	0	0	109.2	A226 W227	A226-A239 CarbonylContact C-O 3.59Å; A226-A239 WeakPolarHBondContact CA-O 3.29Å; W227-A239 HydrophobicContact CD2-CB 4.26Å; W227-A239 HydrophobicContact CH2-CB 4.26Å; W227-A239 HydrophobicContact CZ2-CB 3.58Å; W227-A239 PolarHBondContact N-O 3.36Å; W227-A239 PolarHBondContact O-N 2.92Å
240	T	82.6	Confident	75.2	Confident	28 Å²	28	67.3 Å²	67.3	17%	0.172	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.7	173.4	-58.2	0	0	0	0	108.1	G225 I253 G254	G225-T240 CarbonylContact O-C 3.59Å; G225-T240 VanDerWaalsContact O-CA 3.31Å; G225-T240 WeakPolarHBondContact O-CA 3.15Å; T240-I253 CarbonylContact O-C 3.6Å; T240-I253 WeakPolarHBondContact O-CA 3.17Å; T240-G254 PolarHBondContact O-N 3.09Å; T240-G254 VanDerWaalsContact O-O 3.07Å
241	N	81.5	Confident	74.9	Confident	1 Å²	1	67 Å²	67	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.9	-176	-71.7	2.4	0	0	0	111.3	P209 T223 G225 W227 C252 I253	P209-N241 WeakPolarHBondContact CG-ND2 3.18Å; T223-N241 WeakPolarHBondContact O-CB 3.26Å; T223-N241 PolarHBondContact O-ND2 3.11Å; T223-N241 PolarHBondContact OG1-ND2 2.82Å; G225-N241 PolarHBondContact N-O 2.97Å; G225-N241 PolarHBondContact O-N 2.87Å; W227-N241 PolarHBondContact NE1-ND2 2.81Å; W227-N241 PolarHBondContact NE1-OD1 2.86Å; N241-C252 CarbonylContact C-O 3.5Å; N241-C252 VanDerWaalsContact CA-O 3.23Å; N241-C252 WeakPolarHBondContact CA-O 3.29Å; N241-I253 WeakPolarHBondContact OD1-CA 3.27Å; N241-I253 VanDerWaalsContact OD1-CG1 3.29Å; N241-I253 WeakPolarHBondContact OD1-CG1 3.47Å
242	E	81.2	Confident	74.8	Confident	61 Å²	61	66.3 Å²	66.3	29%	0.285	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	153.7	176.8	-63.7	-82.3	147.7	0	0	109.2	A244 S251 C252 R257	E242-A244 PolarHBondContact O-N 3.05Å; E242-S251 CarbonylContact O-C 3.58Å; E242-S251 WeakPolarHBondContact O-CA 3.4Å; E242-C252 PolarHBondContact N-O 3.05Å; E242-C252 PolarHBondContact O-N 2.85Å; E242-R257 IonicContact OE1-NH1 3.15Å; E242-R257 IonicContact OE2-CZ 2.98Å; E242-R257 IonicContact OE2-NH1 3.38Å; E242-R257 PolarHBondContact OE2-NH1 2.85Å; E242-R257 IonicContact OE2-NH2 3.74Å; E242-R257 PolarHBondContact OE2-NH2 3.03Å
243	P	79.1	Confident	75.1	Confident	55 Å²	55	67.7 Å²	67.7	36%	0.357	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	136.3	176.4	-23.3	33.1	0	0	0	112.6	L224 G245 A250	L224-P243 HydrophobicContact CD2-CB 4.47Å; L224-P243 HydrophobicContact CD2-CG 3.82Å; P243-G245 PolarHBondContact O-N 3.27Å; P243-A250 CarbonylContact C-O 3.59Å; P243-A250 WeakPolarHBondContact CA-O 3.47Å
244	A	71.3	Confident	74.9	Confident	49 Å²	49	64.3 Å²	64.3	41%	0.405	38%	0.379	S	S	.	.	S	Bend	trans	-82.6	46.6	-179.6	0	0	0	0	0	112	E242 A250 C252	E242-A244 PolarHBondContact O-N 3.05Å; A244-A250 HydrophobicContact CB-CB 3.69Å; A244-A250 PolarHBondContact N-O 2.87Å; A244-C252 WeakPolarHBondContact CB-SG 3.21Å
245	G	70.1	Confident	74.4	Confident	46 Å²	46	67 Å²	67	47%	0.474	39%	0.394	S	S	.	.	S	Bend	trans	135.7	-160.4	-175.7	0	0	0	0	0	112.2	P243 T247	P243-G245 PolarHBondContact O-N 3.27Å; G245-T247 PolarHBondContact O-N 3.46Å
246	N	67.1	Low	73.2	Confident	179 Å²	179	67.9 Å²	67.9	96%	0.957	41%	0.406	S	S	*	.	S	Bend	trans	-81.2	2.8	-179.4	-62.6	-6.3	0	0	0	113
247	T	59.5	Low	71.6	Confident	84 Å²	84	73.9 Å²	73.9	52%	0.515	41%	0.413	S	S	.	.	S	Bend	trans	-120.7	140.6	-179	56.6	0	0	0	0	109.9	G245 S249	G245-T247 PolarHBondContact O-N 3.46Å; T247-S249 PolarHBondContact O-N 3.06Å; T247-S249 PolarHBondContact OG1-OG 3.08Å
248	E	68.2	Low	69.6	Low	144 Å²	144	75.6 Å²	75.6	67%	0.673	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	20.3	175	-60.7	-178.1	168.3	0	0	112.4	L222 L224	L222-E248 WeakPolarHBondContact CD1-O 3.26Å; L222-E248 WeakPolarHBondContact CD2-O 3.48Å; L224-E248 HydrophobicContact CD1-CB 4.44Å; L224-E248 HydrophobicContact CD1-CG 4.37Å
249	S	68.1	Low	67.3	Low	90 Å²	90	76 Å²	76	63%	0.629	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-18	-175.4	56.3	0	0	0	0	113.6	T247	T247-S249 PolarHBondContact O-N 3.06Å; T247-S249 PolarHBondContact OG1-OG 3.08Å
250	A	68.3	Low	65.2	Low	28 Å²	28	80.7 Å²	80.7	23%	0.231	48%	0.483	C	S	.	.			trans	-144.8	153.3	177.7	0	0	0	0	0	108.1	P243 A244	P243-A250 CarbonylContact C-O 3.59Å; P243-A250 WeakPolarHBondContact CA-O 3.47Å; A244-A250 HydrophobicContact CB-CB 3.69Å; A244-A250 PolarHBondContact N-O 2.87Å
251	S	73.6	Confident	63	Low	0 Å²	0	84.2 Å²	84.2	0%	0	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.9	178	66	0	0	0	0	109.4	D208 P209 T223 E242	D208-S251 WeakPolarHBondContact CA-O 3.45Å; P209-S251 VanDerWaalsContact CD-O 3.29Å; P209-S251 WeakPolarHBondContact CD-O 3.31Å; P209-S251 WeakPolarHBondContact CD-OG 3.22Å; T223-S251 VanDerWaalsContact O-CB 3.3Å; T223-S251 WeakPolarHBondContact O-CB 3.47Å; T223-S251 PolarHBondContact O-OG 3.35Å; T223-S251 VanDerWaalsContact O-OG 3.07Å; E242-S251 CarbonylContact O-C 3.58Å; E242-S251 WeakPolarHBondContact O-CA 3.4Å
252	C	78.2	Confident	61	Low	55 Å²	55	90.6 Å²	90.6	37%	0.372	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.4	175.1	-65	0	0	0	0	109.6	N241 E242 A244 G254	N241-C252 CarbonylContact C-O 3.5Å; N241-C252 VanDerWaalsContact CA-O 3.23Å; N241-C252 WeakPolarHBondContact CA-O 3.29Å; E242-C252 PolarHBondContact N-O 3.05Å; E242-C252 PolarHBondContact O-N 2.85Å; A244-C252 WeakPolarHBondContact CB-SG 3.21Å; C252-G254 PolarHBondContact O-N 2.85Å; C252-G254 VanDerWaalsContact O-N 3.17Å
253	I	77.5	Confident	58.8	Low	48 Å²	48	96 Å²	96	25%	0.246	57%	0.572	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.2	118.7	173.7	-62.5	163.7	0	0	0	109.4	V205 T240 N241 L273	V205-I253 HydrophobicContact CB-CD1 3.85Å; V205-I253 HydrophobicContact CG1-CD1 3.38Å; V205-I253 HydrophobicContact CG1-CG1 4.22Å; T240-I253 CarbonylContact O-C 3.6Å; T240-I253 WeakPolarHBondContact O-CA 3.17Å; N241-I253 WeakPolarHBondContact OD1-CA 3.27Å; N241-I253 VanDerWaalsContact OD1-CG1 3.29Å; N241-I253 WeakPolarHBondContact OD1-CG1 3.47Å; I253-L273 HydrophobicContact CG2-CD2 4.13Å
254	G	68.5	Low	56.4	Low	25 Å²	25	96.7 Å²	96.7	26%	0.258	58%	0.577	S	S	.	*			trans	-116.2	152.8	176.2	0	0	0	0	0	111.7	T240 C252	T240-G254 PolarHBondContact O-N 3.09Å; T240-G254 VanDerWaalsContact O-O 3.07Å; C252-G254 PolarHBondContact O-N 2.85Å; C252-G254 VanDerWaalsContact O-N 3.17Å
255	K	58.3	Low	54.4	Low	183 Å²	183	105 Å²	105	80%	0.796	60%	0.598	S	S	*	*			trans	-75.9	142.3	167	-170	-173.4	177.8	83.1	0	108.4	R257	K255-R257 PolarHBondContact O-N 3.08Å; K255-R257 VanDerWaalsContact O-N 3.17Å
256	P	52.6	Low	52.4	Low	91 Å²	91	112.7 Å²	112.7	59%	0.591	62%	0.618	S	S	*	*			trans	-51.8	126.2	172.1	19.8	-32.3	0	0	0	109.9	G258	P256-G258 VanDerWaalsContact C-N 3.31Å; P256-G258 PolarHBondContact O-N 2.82Å
257	R	46.9	Very low	50.8	Low	202 Å²	202	114.7 Å²	114.7	76%	0.762	61%	0.613	S	S	*	*			trans	-66.3	91.5	173.3	-70.7	-168.2	-164.9	92.2	4.9	108.5	E242 K255	E242-R257 IonicContact OE1-NH1 3.15Å; E242-R257 IonicContact OE2-CZ 2.98Å; E242-R257 IonicContact OE2-NH1 3.38Å; E242-R257 PolarHBondContact OE2-NH1 2.85Å; E242-R257 IonicContact OE2-NH2 3.74Å; E242-R257 PolarHBondContact OE2-NH2 3.03Å; K255-R257 PolarHBondContact O-N 3.08Å; K255-R257 VanDerWaalsContact O-N 3.17Å
258	G	40	Very low	49.5	Very low	71 Å²	71	116.9 Å²	116.9	73%	0.732	62%	0.621	S	S	*	*			trans	-81.8	114.1	161.4	0	0	0	0	0	108.3	P256	P256-G258 VanDerWaalsContact C-N 3.31Å; P256-G258 PolarHBondContact O-N 2.82Å
259	D	38.6	Very low	47.9	Very low	146 Å²	146	119.3 Å²	119.3	78%	0.781	63%	0.632	S	S	*	*			trans	40.6	112.1	170.1	-145.2	-7.5	0	0	0	117.7	S261	D259-S261 PolarHBondContact O-N 2.82Å
260	A	37.4	Very low	46.3	Very low	109 Å²	109	120.1 Å²	120.1	90%	0.901	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	38.2	-167.9	0	0	0	0	0	115.2
261	S	36.6	Very low	44.6	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	9.4	-175	-175.4	0	0	0	0	115	D259	D259-S261 PolarHBondContact O-N 2.82Å
262	I	39.6	Very low	42.9	Very low	134 Å²	134	124.6 Å²	124.6	69%	0.687	67%	0.671	S	S	*	*			trans	-126.5	121.6	171.5	-51.3	179.9	0	0	0	106.3	P264	I262-P264 HydrophobicContact CB-CG 4.49Å; I262-P264 HydrophobicContact CG2-CB 4.06Å; I262-P264 HydrophobicContact CG2-CG 3.77Å; I262-P264 WeakPolarHBondContact O-CD 3.37Å
263	D	34.4	Very low	41	Very low	174 Å²	174	127.3 Å²	127.3	93%	0.93	68%	0.682	S	S	*	*			trans	-84.4	104	155.5	-82.7	-36.9	0	0	0	107.3
264	P	30.1	Very low	39	Very low	70 Å²	70	131.8 Å²	131.8	46%	0.455	70%	0.696	S	S	.	*			trans	-122.9	103.5	163	38.9	-25.2	0	0	0	108.2	I262	I262-P264 HydrophobicContact CB-CG 4.49Å; I262-P264 HydrophobicContact CG2-CB 4.06Å; I262-P264 HydrophobicContact CG2-CG 3.77Å; I262-P264 WeakPolarHBondContact O-CD 3.37Å
265	W	29.7	Very low	37.6	Very low	223 Å²	223	132.9 Å²	132.9	85%	0.845	70%	0.7	S	S	*	*			trans	75.6	103.5	160.4	-43.2	98.4	0	0	0	115.4	W267	W265-W267 VanDerWaalsContact C-N 3.32Å; W265-W267 PolarHBondContact O-N 3.2Å
266	K	27.1	Very low	36.4	Very low	209 Å²	209	130.9 Å²	130.9	91%	0.909	69%	0.691	S	S	*	*			trans	-26.6	94.3	138.9	-171.9	-179.6	-173.4	-175.7	0	110.4	D268	K266-D268 PolarHBondContact O-N 2.78Å
267	W	33.3	Very low	36.2	Very low	221 Å²	221	127.1 Å²	127.1	84%	0.837	67%	0.666	S	S	*	*			trans	-67.4	117	170.2	-69.9	92	0	0	0	106.9	W265 Q269	W265-W267 VanDerWaalsContact C-N 3.32Å; W265-W267 PolarHBondContact O-N 3.2Å; W267-Q269 PolarHBondContact O-N 3.39Å
268	D	32.2	Very low	36.1	Very low	130 Å²	130	119.9 Å²	119.9	70%	0.695	65%	0.65	S	S	*	*			trans	-58.2	119.9	170.1	-169.3	7.6	0	0	0	108.1	K266 T270	K266-D268 PolarHBondContact O-N 2.78Å; D268-T270 PolarHBondContact O-N 2.89Å; D268-T270 PolarHBondContact OD1-OG1 3.35Å; D268-T270 PolarHBondContact OD2-OG1 2.72Å; D268-T270 VanDerWaalsContact OD2-OG1 3.06Å
269	Q	34.9	Very low	36.4	Very low	194 Å²	194	116.9 Å²	116.9	91%	0.907	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	39.8	-173.9	-70.8	-162.4	-18.5	0	0	112.9	W267	W267-Q269 PolarHBondContact O-N 3.39Å
270	T	34.4	Very low	36.8	Very low	108 Å²	108	110.7 Å²	110.7	66%	0.663	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	14.6	-165.9	54	0	0	0	0	115.4	D268	D268-T270 PolarHBondContact O-N 2.89Å; D268-T270 PolarHBondContact OD1-OG1 3.35Å; D268-T270 PolarHBondContact OD2-OG1 2.72Å; D268-T270 VanDerWaalsContact OD2-OG1 3.06Å
271	G	31.9	Very low	37.5	Very low	61 Å²	61	107 Å²	107	63%	0.629	55%	0.551	S	S	*	*			trans	-135.5	128.9	177.1	0	0	0	0	0	113.4	L273	G271-L273 PolarHBondContact O-N 3.36Å
272	P	38.6	Very low	38.2	Very low	60 Å²	60	105.6 Å²	105.6	39%	0.39	54%	0.535	S	S	.	.			trans	-62.3	136	172.1	-19.9	33.1	0	0	0	110.6	F206 Y274	F206-P272 HydrophobicContact CB-CB 4.11Å; P272-Y274 HydrophobicContact CB-CD1 4.32Å; P272-Y274 HydrophobicContact CB-CD2 4.1Å; P272-Y274 HydrophobicContact CB-CE1 3.89Å; P272-Y274 HydrophobicContact CB-CE2 3.66Å; P272-Y274 HydrophobicContact CB-CG 4.43Å; P272-Y274 HydrophobicContact CG-CE1 4.2Å; P272-Y274 HydrophobicContact CG-CE2 3.84Å; P272-Y274 VanDerWaalsContact CG-OH 3.32Å; P272-Y274 WeakPolarHBondContact CG-OH 3.39Å; P272-Y274 WeakPolarHBondContact O-CD2 3.38Å; P272-Y274 WeakPolarHBondContact O-CE2 3.19Å; P272-Y274 PolarHBondContact O-N 2.76Å; P272-Y274 VanDerWaalsContact O-N 3.14Å
273	L	37.7	Very low	38.7	Very low	113 Å²	113	101 Å²	101	59%	0.592	51%	0.512	S	S	*	.			trans	-71.5	105	165.2	-144	99.9	0	0	0	106.8	I253 G271 C275	I253-L273 HydrophobicContact CG2-CD2 4.13Å; G271-L273 PolarHBondContact O-N 3.36Å; L273-C275 PolarHBondContact O-N 2.99Å
274	Y	36.6	Very low	39.4	Very low	141 Å²	141	97.8 Å²	97.8	55%	0.553	50%	0.501	S	S	*	.			trans	-91.5	103.7	180	-62.5	-85.4	0	0	0	110.3	P272 F276	P272-Y274 HydrophobicContact CB-CD1 4.32Å; P272-Y274 HydrophobicContact CB-CD2 4.1Å; P272-Y274 HydrophobicContact CB-CE1 3.89Å; P272-Y274 HydrophobicContact CB-CE2 3.66Å; P272-Y274 HydrophobicContact CB-CG 4.43Å; P272-Y274 HydrophobicContact CG-CE1 4.2Å; P272-Y274 HydrophobicContact CG-CE2 3.84Å; P272-Y274 VanDerWaalsContact CG-OH 3.32Å; P272-Y274 WeakPolarHBondContact CG-OH 3.39Å; P272-Y274 WeakPolarHBondContact O-CD2 3.38Å; P272-Y274 WeakPolarHBondContact O-CE2 3.19Å; P272-Y274 PolarHBondContact O-N 2.76Å; P272-Y274 VanDerWaalsContact O-N 3.14Å; Y274-F276 HydrophobicContact CD1-CE2 4.12Å; Y274-F276 AromaticContact CD1-CZ 3.86Å; Y274-F276 HydrophobicContact CD1-CZ 3.86Å; Y274-F276 AromaticContact CG-CE2 3.94Å; Y274-F276 HydrophobicContact CG-CE2 3.94Å; Y274-F276 HydrophobicContact CG-CZ 4.15Å
275	C	38.2	Very low	40.1	Very low	48 Å²	48	97.9 Å²	97.9	32%	0.324	51%	0.508	S	S	.	.			trans	-89	108.8	160.8	-72.5	0	0	0	0	108.2	T204 L273	T204-C275 WeakPolarHBondContact CA-O 3.41Å; L273-C275 PolarHBondContact O-N 2.99Å
276	F	34.3	Very low	40.8	Very low	141 Å²	141	90 Å²	90	62%	0.618	49%	0.485	S	S	*	.			trans	-95.9	113.5	170.2	-68.2	-78.3	0	0	0	108.9	Y274	Y274-F276 HydrophobicContact CD1-CE2 4.12Å; Y274-F276 AromaticContact CD1-CZ 3.86Å; Y274-F276 HydrophobicContact CD1-CZ 3.86Å; Y274-F276 AromaticContact CG-CE2 3.94Å; Y274-F276 HydrophobicContact CG-CE2 3.94Å; Y274-F276 HydrophobicContact CG-CZ 4.15Å
277	V	46.7	Very low	41.4	Very low	12 Å²	12	85.1 Å²	85.1	7%	0.073	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.5	169.7	174.1	0	0	0	0	108.5	F202 C203 L230 F235 V237 Q279	F202-V277 WeakPolarHBondContact CA-O 3.4Å; C203-V277 HydrophobicContact CB-CB 4.33Å; C203-V277 PolarHBondContact N-O 3.42Å; C203-V277 VanDerWaalsContact N-O 3.14Å; C203-V277 PolarHBondContact O-N 2.87Å; L230-V277 HydrophobicContact CD2-CG1 3.5Å; L230-V277 VanDerWaalsContact CD2-CG1 3.5Å; F235-V277 HydrophobicContact CE2-CG1 3.37Å; F235-V277 HydrophobicContact CE2-CG2 4.45Å; F235-V277 HydrophobicContact CZ-CG1 3.48Å; F235-V277 VanDerWaalsContact CZ-CG1 3.48Å; V237-V277 HydrophobicContact CG2-CG2 3.96Å; V277-Q279 HydrophobicContact CG1-CG 4.24Å
278	A	44.7	Very low	41.5	Very low	50 Å²	50	78.4 Å²	78.4	41%	0.413	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.9	174.5	0	0	0	0	0	109.6	Y200 R201	Y200-A278 HydrophobicContact CD1-CB 3.82Å; Y200-A278 HydrophobicContact CG-CB 4.36Å; R201-A278 CarbonylContact O-C 3.53Å; R201-A278 VanDerWaalsContact O-CA 3.25Å; R201-A278 WeakPolarHBondContact O-CA 3.29Å
279	Q	47.5	Very low	41.8	Very low	8 Å²	8	82 Å²	82	4%	0.037	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137	172.4	-73.4	-168.8	-82.6	0	0	111.6	Y200 R201 L214 L230 N232 F235 V277	Y200-Q279 CarbonylContact C-O 3.45Å; R201-Q279 PolarHBondContact N-O 3.33Å; R201-Q279 PolarHBondContact O-N 2.83Å; L214-Q279 HydrophobicContact CD2-CB 4.4Å; L214-Q279 HydrophobicContact CD2-CG 4.37Å; L230-Q279 HydrophobicContact CD2-CG 4.07Å; N232-Q279 PolarHBondContact ND2-NE2 2.92Å; F235-Q279 HydrophobicContact CE1-CG 4.04Å; F235-Q279 HydrophobicContact CZ-CG 3.62Å; V277-Q279 HydrophobicContact CG1-CG 4.24Å
280	P	47.1	Very low	41.8	Very low	16 Å²	16	78.9 Å²	78.9	10%	0.104	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	141.2	168.7	-22.6	32.8	0	0	0	112	Y189 Y191 D282	Y189-P280 HydrophobicContact CD1-CG 4.39Å; Y189-P280 HydrophobicContact CE1-CG 3.56Å; Y191-P280 HydrophobicContact CD2-CB 3.94Å; Y191-P280 HydrophobicContact CD2-CG 3.9Å; Y191-P280 HydrophobicContact CE2-CB 3.63Å; Y191-P280 HydrophobicContact CE2-CG 4.04Å; P280-D282 VanDerWaalsContact C-N 3.3Å; P280-D282 PolarHBondContact O-N 3.17Å
281	V	51.5	Low	41.7	Very low	32 Å²	32	77.7 Å²	77.7	19%	0.194	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.1	179.9	-174.2	0	0	0	0	112.2	S198 G199 R201 D283	S198-V281 VanDerWaalsContact C-CG2 3.42Å; S198-V281 WeakPolarHBondContact O-CB 3.15Å; S198-V281 WeakPolarHBondContact O-CG2 3.16Å; S198-V281 PolarHBondContact O-N 2.75Å; S198-V281 VanDerWaalsContact OG-CB 3.23Å; S198-V281 WeakPolarHBondContact OG-CB 3.43Å; S198-V281 WeakPolarHBondContact OG-CG1 3.16Å; G199-V281 WeakPolarHBondContact O-CG2 3.5Å; G199-V281 PolarHBondContact O-N 2.75Å; G199-V281 VanDerWaalsContact O-N 3.17Å; R201-V281 HydrophobicContact CG-CG2 3.7Å; R201-V281 PolarHBondContact NH1-O 3.02Å; R201-V281 VanDerWaalsContact NH2-CG1 3.29Å; R201-V281 PolarHBondContact NH2-O 3.47Å; V281-D283 VanDerWaalsContact C-N 3.3Å; V281-D283 PolarHBondContact O-N 3.34Å
282	D	51.1	Low	41.8	Very low	73 Å²	73	80 Å²	80	39%	0.39	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.1	-179	-63.6	-33.9	0	0	0	115.2	A197 P280 P284	A197-D282 WeakPolarHBondContact CA-OD1 3.1Å; A197-D282 WeakPolarHBondContact CA-OD2 3.41Å; A197-D282 WeakPolarHBondContact CB-OD2 3.41Å; P280-D282 VanDerWaalsContact C-N 3.3Å; P280-D282 PolarHBondContact O-N 3.17Å; D282-P284 VanDerWaalsContact O-CD 3.3Å; D282-P284 WeakPolarHBondContact O-CD 3.19Å
283	D	50	Low	41.5	Very low	37 Å²	37	81.6 Å²	81.6	20%	0.198	49%	0.487	C	S	.	.	S	Bend	trans	-74.6	118.8	169.5	-82.5	-57.7	0	0	0	108.5	Y189 Y234 V281 A285	Y189-D283 PolarHBondContact OH-OD2 3.13Å; Y234-D283 PolarHBondContact OH-OD1 2.95Å; V281-D283 VanDerWaalsContact C-N 3.3Å; V281-D283 PolarHBondContact O-N 3.34Å; D283-A285 PolarHBondContact O-N 3.48Å
284	P	48.6	Very low	41.5	Very low	106 Å²	106	80.1 Å²	80.1	69%	0.688	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-58.7	135.2	170.5	25	-31.4	0	0	0	107.9	D282 P286	D282-P284 VanDerWaalsContact O-CD 3.3Å; D282-P284 WeakPolarHBondContact O-CD 3.19Å; P284-P286 VanDerWaalsContact O-CD 3.27Å; P284-P286 WeakPolarHBondContact O-CD 3.26Å
285	A	46.3	Very low	41.5	Very low	73 Å²	73	76.8 Å²	76.8	60%	0.603	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-48.2	118.4	174.3	0	0	0	0	0	108.4	D283 S287 M295	D283-A285 PolarHBondContact O-N 3.48Å; A285-S287 PolarHBondContact O-N 3.31Å; A285-S287 VanDerWaalsContact O-N 3.1Å; A285-M295 HydrophobicContact CB-SD 4.36Å
286	P	43	Very low	41.7	Very low	57 Å²	57	76.9 Å²	76.9	37%	0.37	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-54.2	123.4	179.8	15.4	-30.8	0	0	0	109.4	N232 P284 M295	N232-P286 HydrophobicContact CB-CG 4.41Å; P284-P286 VanDerWaalsContact O-CD 3.27Å; P284-P286 WeakPolarHBondContact O-CD 3.26Å; P286-M295 WeakPolarHBondContact CD-SD 3.29Å; P286-M295 HydrophobicContact CG-SD 3.72Å
287	S	40.5	Very low	42.5	Very low	106 Å²	106	72.9 Å²	72.9	74%	0.741	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-52.1	133	164.4	-28.3	0	0	0	0	107.2	A285 R289	A285-S287 PolarHBondContact O-N 3.31Å; A285-S287 VanDerWaalsContact O-N 3.1Å; S287-R289 PolarHBondContact O-N 3.41Å; S287-R289 VanDerWaalsContact O-N 3.11Å
288	P	35.5	Very low	42.9	Very low	80 Å²	80	77.2 Å²	77.2	52%	0.519	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-55.7	123.9	-178.5	19.3	-29.6	0	0	0	109.8	S290 T294	P288-S290 PolarHBondContact O-N 2.87Å; P288-T294 HydrophobicContact CB-CG2 3.75Å; P288-T294 HydrophobicContact CG-CG2 3.61Å
289	R	37.7	Very low	42.8	Very low	207 Å²	207	78.6 Å²	78.6	78%	0.781	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-63.3	133.4	156.4	-74.5	-172.9	-174.4	-156.2	2.9	106.2	S287 G291 Q292	S287-R289 PolarHBondContact O-N 3.41Å; S287-R289 VanDerWaalsContact O-N 3.11Å; R289-G291 PolarHBondContact O-N 3.06Å; R289-Q292 PolarHBondContact O-N 3.43Å
290	S	34.8	Very low	42.5	Very low	127 Å²	127	82.3 Å²	82.3	89%	0.888	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	116.1	-173.7	63.3	0	0	0	0	111.5	P288	P288-S290 PolarHBondContact O-N 2.87Å
291	G	33.2	Very low	42.3	Very low	84 Å²	84	86 Å²	86	87%	0.866	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.7	2.2	170.6	0	0	0	0	0	117.2	R289	R289-G291 PolarHBondContact O-N 3.06Å
292	Q	33.1	Very low	41.7	Very low	110 Å²	110	89.2 Å²	89.2	51%	0.514	58%	0.58	S	S	.	*	S	Bend	trans	-125.1	135.5	179.1	-76.3	171.7	-38.7	0	0	112	R289 T294	R289-Q292 PolarHBondContact O-N 3.43Å; Q292-T294 PolarHBondContact O-N 3.09Å; Q292-T294 VanDerWaalsContact O-N 3.14Å
293	A	33.6	Very low	41.2	Very low	92 Å²	92	90.2 Å²	90.2	76%	0.76	59%	0.592	S	S	*	*			trans	-52.2	116.7	-174.7	0	0	0	0	0	110.7
294	T	38.3	Very low	40.6	Very low	83 Å²	83	93.7 Å²	93.7	51%	0.509	62%	0.618	S	S	.	*			trans	-49.3	138.7	168.3	22.5	0	0	0	0	110.4	P288 Q292 G296	P288-T294 HydrophobicContact CB-CG2 3.75Å; P288-T294 HydrophobicContact CG-CG2 3.61Å; Q292-T294 PolarHBondContact O-N 3.09Å; Q292-T294 VanDerWaalsContact O-N 3.14Å; T294-G296 PolarHBondContact O-N 3.3Å
295	M	35.2	Very low	40	Very low	70 Å²	70	92.9 Å²	92.9	35%	0.345	61%	0.613	S	S	.	*	S	Bend	trans	-38.9	107.6	159	-72.7	162.6	103.3	0	0	110.1	L214 L230 A285 P286	L214-M295 HydrophobicContact CD1-CE 3.28Å; L230-M295 HydrophobicContact CD1-CE 4.19Å; L230-M295 HydrophobicContact CD1-CG 4.38Å; A285-M295 HydrophobicContact CB-SD 4.36Å; P286-M295 WeakPolarHBondContact CD-SD 3.29Å; P286-M295 HydrophobicContact CG-SD 3.72Å
296	G	42.6	Very low	39.5	Very low	50 Å²	50	94.4 Å²	94.4	52%	0.515	61%	0.614	S	S	.	*	S	Bend	trans	142.5	100.4	178.2	0	0	0	0	0	110.5	T294	T294-G296 PolarHBondContact O-N 3.3Å
297	A	51.7	Low	39.2	Very low	57 Å²	57	97.5 Å²	97.5	47%	0.471	63%	0.634	S	S	.	*			trans	64.8	136.7	161.6	0	0	0	0	0	118	E219	E219-A297 VanDerWaalsContact CD-CB 3.42Å; E219-A297 WeakPolarHBondContact OE1-CB 3.38Å; E219-A297 WeakPolarHBondContact OE2-CA 3.41Å
298	C	54.3	Low	39.1	Very low	104 Å²	104	96.7 Å²	96.7	70%	0.703	63%	0.625	S	S	*	*			trans	-67.5	0	141.1	-37.1	0	0	0	0	106.6	C221	C221-C298 HydrophobicContact CB-CB 3.5Å; C221-C298 VanDerWaalsContact CB-CB 3.5Å; C221-C298 WeakPolarHBondContact CB-SG 3.18Å; C221-C298 WeakPolarHBondContact SG-CB 3.24Å; C221-C298 CovalentContact SG-SG 2Å; C221-C298 PolarHBondContact SG-SG 3Å

Retrieved 298 of 298 residues in 334.4 ms (Link to these results)

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