A0A3Q0KRD2_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KRD2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 210 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	44	Very low	50.4	Low	237 Å²	237	167.6 Å²	167.6	100%	1.167	86%	0.86	S	S	*	*				0	121.2	0	-78.4	-179.2	160.7	0	0	108.4
2	N	44.1	Very low	50	Low	134 Å²	134	164.3 Å²	164.3	72%	0.717	85%	0.853	S	S	*	*			trans	47.7	137.3	156.8	-64.4	-26.3	0	0	0	120.1
3	R	45.9	Very low	50.2	Low	219 Å²	219	162.2 Å²	162.2	83%	0.826	85%	0.853	S	S	*	*			cis	-167.4	149.6	0.6	-108.1	171.7	-161.2	177.2	1.5	107.2
4	N	47.9	Very low	50.6	Low	166 Å²	166	157.9 Å²	157.9	89%	0.888	84%	0.842	S	S	*	*			trans	-64.3	155.4	175.9	-61.2	-35.8	0	0	0	113.8
5	G	56	Low	50.3	Low	83 Å²	83	158.6 Å²	158.6	86%	0.856	85%	0.846	S	S	*	*			trans	-163.7	99.4	163	0	0	0	0	0	111.3
6	I	50.8	Low	50.4	Low	144 Å²	144	155.9 Å²	155.9	74%	0.738	84%	0.844	S	S	*	*			trans	-87.5	133.4	-178.6	-64.8	160.5	0	0	0	109.6
7	I	57.9	Low	50.6	Low	164 Å²	164	155.6 Å²	155.6	84%	0.841	84%	0.84	S	S	*	*			trans	-147	129.4	140.9	-58.6	-173	0	0	0	109
8	K	47.7	Very low	50.4	Low	181 Å²	181	154.9 Å²	154.9	79%	0.787	84%	0.836	S	S	*	*			trans	-93.2	137.3	178.6	-67.9	175.5	175.8	177.3	0	110
9	E	57.5	Low	50.5	Low	190 Å²	190	153.6 Å²	153.6	89%	0.888	83%	0.828	S	S	*	*			trans	-134.7	136	154	-70.9	-165.3	169.6	0	0	110.9
10	K	48.2	Very low	50.5	Low	199 Å²	199	155.1 Å²	155.1	87%	0.865	83%	0.83	S	S	*	*			trans	-92.6	138.5	-175.3	-63.6	173.4	176.1	178.7	0	109
11	S	54.1	Low	50.4	Low	127 Å²	127	155.9 Å²	155.9	89%	0.888	83%	0.828	S	S	*	*			trans	-138.2	123.7	161	37.4	0	0	0	0	109.8
12	T	45.7	Very low	50.6	Low	127 Å²	127	155.8 Å²	155.8	78%	0.779	82%	0.815	S	S	*	*			trans	-130.5	121	179.6	-13.6	0	0	0	0	105.9
13	T	52.8	Low	50.8	Low	138 Å²	138	156.7 Å²	156.7	85%	0.847	82%	0.818	S	S	*	*			trans	163.1	139.5	159.7	26.1	0	0	0	0	106.7
14	S	55.4	Low	50.9	Low	101 Å²	101	152 Å²	152	71%	0.706	81%	0.814	S	S	*	*			cis	178.9	136.8	-3.2	39.5	0	0	0	0	104.5	S16	S14-S16 PolarHBondContact O-N 3.49Å
15	D	46.5	Very low	51	Low	169 Å²	169	149.2 Å²	149.2	90%	0.904	80%	0.803	S	S	*	*			trans	-63.5	126.8	178.9	-66.9	-44.7	0	0	0	111.7
16	S	52.5	Low	50.6	Low	115 Å²	115	150.8 Å²	150.8	80%	0.804	80%	0.798	S	S	*	*			trans	-93.9	113.4	178.5	179.4	0	0	0	0	110	S14	S14-S16 PolarHBondContact O-N 3.49Å
17	I	54	Low	50.5	Low	151 Å²	151	151.7 Å²	151.7	77%	0.774	80%	0.803	S	S	*	*			trans	-78.4	118.5	171.6	-63.7	169.7	0	0	0	108.4	N19	I17-N19 PolarHBondContact O-N 3.28Å
18	D	46.3	Very low	49.8	Very low	144 Å²	144	151 Å²	151	77%	0.77	80%	0.796	S	S	*	*			trans	-78.3	101.1	-175.8	-138.4	0.2	0	0	0	110.5	Q20	D18-Q20 PolarHBondContact O-N 3.38Å
19	N	52.7	Low	49.7	Very low	130 Å²	130	147.7 Å²	147.7	70%	0.695	79%	0.793	S	S	*	*			trans	-85.2	100.7	175.5	-100.1	-24.4	0	0	0	109.9	I17 H21	I17-N19 PolarHBondContact O-N 3.28Å; N19-H21 PolarHBondContact O-N 3.15Å
20	Q	50.5	Low	49.3	Very low	183 Å²	183	144.7 Å²	144.7	86%	0.855	79%	0.788	S	S	*	*			trans	-69.2	95.6	171	-66.3	-172	-1	0	0	110.9	D18 R22	D18-Q20 PolarHBondContact O-N 3.38Å; Q20-R22 PolarHBondContact O-N 2.95Å; Q20-R22 VanDerWaalsContact O-N 3.1Å
21	H	48	Very low	49.5	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.796	78%	0.778	S	S	*	*			trans	-72.5	98.4	165.2	-78.1	-41.6	0	0	0	110.4	N19 I23	N19-H21 PolarHBondContact O-N 3.15Å; H21-I23 PolarHBondContact O-N 2.72Å
22	R	48.3	Very low	49.4	Very low	235 Å²	235	145.7 Å²	145.7	89%	0.887	78%	0.776	S	S	*	*			trans	-67.8	97.9	169.3	-141	-178.9	-160.6	-169.6	5.4	109.1	Q20 T24	Q20-R22 PolarHBondContact O-N 2.95Å; Q20-R22 VanDerWaalsContact O-N 3.1Å; R22-T24 PolarHBondContact O-N 2.61Å
23	I	47.2	Very low	49.7	Very low	152 Å²	152	146.5 Å²	146.5	78%	0.779	78%	0.78	S	S	*	*			trans	-65.6	98.1	171.4	-59.5	173.5	0	0	0	107.4	H21 T25	H21-I23 PolarHBondContact O-N 2.72Å; I23-T25 PolarHBondContact O-N 3.26Å
24	T	49.3	Very low	49.9	Very low	121 Å²	121	145.5 Å²	145.5	74%	0.742	76%	0.761	S	S	*	*			trans	-82.9	102.6	171.6	-50.9	0	0	0	0	106.7	R22	R22-T24 PolarHBondContact O-N 2.61Å
25	T	49.8	Very low	50.4	Low	108 Å²	108	143.6 Å²	143.6	66%	0.663	75%	0.748	S	S	*	*			trans	-63.7	133.3	171.9	44.2	0	0	0	0	109	I23 I27	I23-T25 PolarHBondContact O-N 3.26Å; T25-I27 PolarHBondContact O-N 2.97Å; T25-I27 VanDerWaalsContact O-N 3.16Å
26	P	46.6	Very low	51.4	Low	116 Å²	116	137.6 Å²	137.6	75%	0.753	72%	0.715	S	S	*	*			trans	-65.8	120.3	177	25.9	-31.1	0	0	0	108.6	Q28	P26-Q28 PolarHBondContact O-N 3.01Å
27	I	48.5	Very low	52.2	Low	162 Å²	162	138.7 Å²	138.7	83%	0.831	70%	0.703	S	S	*	*			trans	-56.6	109.1	171.9	-62.9	166.6	0	0	0	106.7	T25	T25-I27 PolarHBondContact O-N 2.97Å; T25-I27 VanDerWaalsContact O-N 3.16Å
28	Q	44.9	Very low	52.9	Low	149 Å²	149	136.4 Å²	136.4	70%	0.696	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.3	128	176.1	-69.4	-158.1	-15.4	0	0	108.5	P26 T30	P26-Q28 PolarHBondContact O-N 3.01Å; Q28-T30 PolarHBondContact O-N 3.39Å; Q28-T30 VanDerWaalsContact O-N 3.12Å
29	P	45.9	Very low	53.9	Low	112 Å²	112	135 Å²	135	73%	0.727	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-59	123.4	178.9	23.5	-31.8	0	0	0	108.4	L31	P29-L31 PolarHBondContact O-N 2.93Å; P29-L31 VanDerWaalsContact O-N 3.13Å
30	T	48.6	Very low	54.6	Low	128 Å²	128	131.7 Å²	131.7	79%	0.785	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-54.8	123.1	172.9	50	0	0	0	0	107.9	Q28 R32	Q28-T30 PolarHBondContact O-N 3.39Å; Q28-T30 VanDerWaalsContact O-N 3.12Å; T30-R32 PolarHBondContact O-N 3.07Å
31	L	51.2	Low	55.7	Low	125 Å²	125	123.1 Å²	123.1	65%	0.654	63%	0.626	S	S	*	*			trans	-64.6	85.7	-178.1	-66.3	170.7	0	0	0	108.7	P29 T33	P29-L31 PolarHBondContact O-N 2.93Å; P29-L31 VanDerWaalsContact O-N 3.13Å; L31-T33 PolarHBondContact O-N 2.98Å
32	R	51.7	Low	56.9	Low	222 Å²	222	116.6 Å²	116.6	84%	0.838	60%	0.599	S	S	*	*			trans	-52.8	127.8	166.7	-83.7	-167.8	177.5	-164.6	0.7	107.3	T30 R34	T30-R32 PolarHBondContact O-N 3.07Å; R32-R34 WeakPolarHBondContact O-CG 3.49Å; R32-R34 PolarHBondContact O-N 3.38Å
33	T	52.4	Low	58.1	Low	143 Å²	143	110.6 Å²	110.6	88%	0.877	59%	0.59	S	S	*	*			trans	-53.4	102.2	173.3	36.1	0	0	0	0	108.7	L31	L31-T33 PolarHBondContact O-N 2.98Å
34	R	58.5	Low	59.3	Low	117 Å²	117	107.1 Å²	107.1	44%	0.442	58%	0.576	S	S	.	*			trans	-71.1	139.5	-176	-62.9	178.1	174.2	166.9	-3.2	108.8	R32 I36 Y95 Y113	R32-R34 WeakPolarHBondContact O-CG 3.49Å; R32-R34 PolarHBondContact O-N 3.38Å; R34-I36 PolarHBondContact O-N 3.44Å; R34-Y95 PolarHBondContact NH1-OH 2.84Å; R34-Y95 VanDerWaalsContact NH1-OH 3.14Å; R34-Y113 HydrophobicContact CB-CE2 3.7Å
35	S	65.7	Low	60.4	Low	61 Å²	61	110.7 Å²	110.7	43%	0.427	58%	0.582	S	S	.	*			trans	-63.7	129.6	173.8	171.7	0	0	0	0	109.8	Y37 L38	S35-Y37 PolarHBondContact O-N 3.28Å; S35-L38 PolarHBondContact O-N 2.94Å
36	I	67.3	Low	61.5	Low	44 Å²	44	107.7 Å²	107.7	23%	0.226	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-13.1	-173.7	-60.3	152.5	0	0	0	111.6	R34 G117 Q120 Q121	R34-I36 PolarHBondContact O-N 3.44Å; I36-G117 VanDerWaalsContact CD1-CA 3.45Å; I36-Q120 HydrophobicContact CD1-CB 3.36Å; I36-Q120 HydrophobicContact CD1-CG 3.74Å; I36-Q121 HydrophobicContact CG2-CG 3.98Å
37	Y	68.2	Low	62.9	Low	138 Å²	138	109.7 Å²	109.7	54%	0.541	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	-0.4	-175.6	-62.4	-65.9	0	0	0	114	S35 D124	S35-Y37 PolarHBondContact O-N 3.28Å; Y37-D124 PolarHBondContact OH-OD2 2.99Å
38	L	69.4	Low	64.3	Low	103 Å²	103	106.2 Å²	106.2	54%	0.539	55%	0.551	S	S	.	*	S	Bend	trans	-79.3	146.6	177.2	-66.2	173.3	0	0	0	110.8	S35 Y40	S35-L38 PolarHBondContact O-N 2.94Å; L38-Y40 PolarHBondContact O-N 3.48Å
39	V	67.3	Low	66	Low	113 Å²	113	105 Å²	105	69%	0.685	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-53.3	133.3	169.9	178.1	0	0	0	0	108.4	P41 P42	V39-P41 CarbonylContact O-C 3.43Å; V39-P41 VanDerWaalsContact O-O 3.06Å; V39-P42 WeakPolarHBondContact O-CA 3.39Å
40	Y	66.8	Low	67.6	Low	62 Å²	62	101.4 Å²	101.4	24%	0.243	53%	0.525	C	S	.	.	S	Bend	trans	-101.6	126.9	-174	-174.8	-71.5	0	0	0	110.2	L38 Y95 Y96 Y110	L38-Y40 PolarHBondContact O-N 3.48Å; Y40-Y95 AromaticContact CD2-CE1 3.93Å; Y40-Y95 HydrophobicContact CD2-CE1 3.93Å; Y40-Y95 AromaticContact CE1-CD1 3.64Å; Y40-Y95 HydrophobicContact CE1-CD1 3.64Å; Y40-Y95 AromaticContact CE1-CE1 3.85Å; Y40-Y95 HydrophobicContact CE1-CE1 3.85Å; Y40-Y95 HydrophobicContact CE1-CG 4.33Å; Y40-Y95 AromaticContact CE2-CD1 3.73Å; Y40-Y95 HydrophobicContact CE2-CD1 3.73Å; Y40-Y95 AromaticContact CE2-CE1 3.03Å; Y40-Y95 HydrophobicContact CE2-CE1 3.03Å; Y40-Y95 AromaticContact CE2-CZ 3.53Å; Y40-Y95 AromaticContact CZ-CD1 3.16Å; Y40-Y95 AromaticContact CZ-CE1 3Å; Y40-Y95 AromaticContact CZ-CZ 3.89Å; Y40-Y95 WeakPolarHBondContact OH-CD1 3.35Å; Y40-Y95 WeakPolarHBondContact OH-CE1 3.44Å; Y40-Y96 HydrophobicContact CD1-CE1 4.39Å; Y40-Y96 HydrophobicContact CD1-CE2 4.43Å; Y40-Y96 AromaticContact CD1-CZ 3.85Å; Y40-Y96 VanDerWaalsContact CD1-OH 3.3Å; Y40-Y96 WeakPolarHBondContact CD1-OH 3.34Å; Y40-Y96 HydrophobicContact CE1-CD1 4.16Å; Y40-Y96 HydrophobicContact CE1-CD2 4.44Å; Y40-Y96 AromaticContact CE1-CE1 3.35Å; Y40-Y96 HydrophobicContact CE1-CE1 3.35Å; Y40-Y96 AromaticContact CE1-CE2 3.71Å; Y40-Y96 HydrophobicContact CE1-CE2 3.71Å; Y40-Y96 AromaticContact CE1-CZ 3.11Å; Y40-Y96 WeakPolarHBondContact CE1-OH 3.4Å; Y40-Y96 AromaticContact CZ-CE1 3.64Å; Y40-Y96 AromaticContact CZ-CZ 3.91Å; Y40-Y96 WeakPolarHBondContact OH-CD1 3.23Å; Y40-Y96 WeakPolarHBondContact OH-CE1 3.34Å; Y40-Y110 WeakPolarHBondContact OH-CE2 3.45Å; Y40-Y110 PolarHBondContact OH-OH 3.22Å
41	P	75.1	Confident	69.2	Low	3 Å²	3	97.4 Å²	97.4	2%	0.019	50%	0.502	C	S	.	.	S	Bend	cis	-70	154.8	-14.1	32.6	-35.3	0	0	0	110.8	V39 R91 Y92 Y95	V39-P41 CarbonylContact O-C 3.43Å; V39-P41 VanDerWaalsContact O-O 3.06Å; P41-R91 HydrophobicContact CG-CG 4.27Å; P41-Y92 VanDerWaalsContact CD-CD1 3.44Å; P41-Y92 HydrophobicContact CG-CD1 3.83Å; P41-Y92 HydrophobicContact CG-CD2 4.38Å; P41-Y92 HydrophobicContact CG-CE1 3.84Å; P41-Y92 HydrophobicContact CG-CE2 4.36Å; P41-Y92 HydrophobicContact CG-CG 4.1Å; P41-Y95 HydrophobicContact CB-CD2 3.4Å; P41-Y95 HydrophobicContact CB-CE2 3.98Å; P41-Y95 HydrophobicContact CB-CG 3.78Å
42	P	72.8	Confident	70.9	Confident	34 Å²	34	96.1 Å²	96.1	22%	0.221	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-59.8	146.4	-178.3	25.6	-33.3	0	0	0	110.3	V39 V44 Y95	V39-P42 WeakPolarHBondContact O-CA 3.39Å; P42-V44 WeakPolarHBondContact O-CG2 3.49Å; P42-V44 PolarHBondContact O-N 3.06Å; P42-Y95 VanDerWaalsContact CD-CE2 3.48Å; P42-Y95 HydrophobicContact CG-CE2 4.34Å
43	P	73.2	Confident	72.5	Confident	109 Å²	109	94.8 Å²	94.8	71%	0.708	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-59.7	124.2	175.6	23.6	-31.5	0	0	0	109.4
44	V	72.1	Confident	73.9	Confident	80 Å²	80	91.3 Å²	91.3	49%	0.485	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-102.1	137.7	177.7	-178	0	0	0	0	108	P42 Y46 R91	P42-V44 WeakPolarHBondContact O-CG2 3.49Å; P42-V44 PolarHBondContact O-N 3.06Å; V44-Y46 PolarHBondContact O-N 3.46Å; V44-R91 HydrophobicContact CG2-CG 4.05Å
45	K	73	Confident	74.8	Confident	196 Å²	196	89.7 Å²	89.7	85%	0.852	47%	0.471	S	S	*	.			trans	-72.3	113.8	165.7	-67.3	-175.1	179	-176.6	0	107.2	D47	K45-D47 PolarHBondContact O-N 3.45Å
46	Y	71.9	Confident	75	Confident	44 Å²	44	88.8 Å²	88.8	17%	0.173	46%	0.464	C	S	.	.			trans	-65.2	128.2	177.1	-62.8	-67.5	0	0	0	109.9	V44 P48 N49 E88 R91	V44-Y46 PolarHBondContact O-N 3.46Å; Y46-P48 CarbonylContact C-O 2.99Å; Y46-P48 CarbonylContact O-C 3.35Å; Y46-N49 WeakPolarHBondContact O-CA 3.33Å; Y46-N49 PolarHBondContact O-N 2.95Å; Y46-N49 PolarHBondContact O-OD1 2.49Å; Y46-E88 WeakPolarHBondContact OH-CG 3.28Å; Y46-E88 PolarHBondContact OH-OE1 2.94Å; Y46-R91 PolarHBondContact OH-NH1 3.04Å
47	D	75.6	Confident	75	Confident	158 Å²	158	96.7 Å²	96.7	85%	0.845	49%	0.492	S	S	*	.	S	Bend	trans	-124.5	113.9	168.9	-166.5	5.1	0	0	0	107.9	K45	K45-D47 PolarHBondContact O-N 3.45Å
48	P	77.9	Confident	74.8	Confident	89 Å²	89	98.5 Å²	98.5	58%	0.578	50%	0.504	S	S	*	.	S	Bend	cis	-67.8	149.2	2.3	29	-34.5	0	0	0	113	Y46	Y46-P48 CarbonylContact C-O 2.99Å; Y46-P48 CarbonylContact O-C 3.35Å
49	N	81	Confident	74.3	Confident	125 Å²	125	96.7 Å²	96.7	67%	0.668	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-56.1	144.2	170.8	-77.2	-48.4	0	0	0	109.6	Y46	Y46-N49 WeakPolarHBondContact O-CA 3.33Å; Y46-N49 PolarHBondContact O-N 2.95Å; Y46-N49 PolarHBondContact O-OD1 2.49Å
50	P	79.5	Confident	73.8	Confident	35 Å²	35	95.2 Å²	95.2	23%	0.227	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-58.2	140.7	177.4	25.6	-33.9	0	0	0	109.6	M84	P50-M84 HydrophobicContact CB-CG 3.66Å; P50-M84 HydrophobicContact CB-SD 4.09Å; P50-M84 HydrophobicContact CG-CG 4.43Å
51	P	82.7	Confident	73.6	Confident	44 Å²	44	102.9 Å²	102.9	29%	0.286	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-55	146.6	-176.8	18.9	-28.4	0	0	0	110.3	Y76 R80	P51-Y76 HydrophobicContact CB-CE2 4.42Å; P51-Y76 WeakPolarHBondContact CB-OH 3.49Å; P51-R80 HydrophobicContact CG-CB 4.11Å; P51-R80 HydrophobicContact CG-CG 4Å; P51-R80 VanDerWaalsContact O-CD 3.28Å; P51-R80 WeakPolarHBondContact O-CD 3.35Å; P51-R80 PolarHBondContact O-NE 2.97Å
52	P	86	Confident	73	Confident	99 Å²	99	110 Å²	110	64%	0.643	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-61.9	143	-173.4	24.7	-33.8	0	0	0	111	I54 Y76	P52-I54 PolarHBondContact O-N 3.47Å; P52-Y76 WeakPolarHBondContact CD-OH 3.38Å; P52-Y76 WeakPolarHBondContact O-CE1 3.49Å; P52-Y76 VanDerWaalsContact O-CZ 3.3Å; P52-Y76 PolarHBondContact O-OH 3.1Å
53	R	86.3	Confident	72.5	Confident	194 Å²	194	113.1 Å²	113.1	73%	0.732	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-70.9	124.8	177.1	-173.1	178.3	-177.2	-175.1	1.1	109.3
54	I	81.5	Confident	71.8	Confident	69 Å²	69	113.6 Å²	113.6	35%	0.354	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-93	146.3	172.2	-56.4	170.6	0	0	0	108.8	P52 P56 Y59 Y76 I77	P52-I54 PolarHBondContact O-N 3.47Å; I54-P56 WeakPolarHBondContact O-CD 3.36Å; I54-Y59 WeakPolarHBondContact CG2-OH 3.36Å; I54-Y76 HydrophobicContact CB-CD1 4.15Å; I54-Y76 HydrophobicContact CB-CE1 4.05Å; I54-Y76 HydrophobicContact CD1-CD1 3.53Å; I54-Y76 HydrophobicContact CD1-CD2 4.21Å; I54-Y76 HydrophobicContact CD1-CE1 3.36Å; I54-Y76 HydrophobicContact CD1-CE2 4.04Å; I54-Y76 HydrophobicContact CD1-CG 3.95Å; I54-Y76 HydrophobicContact CG1-CD1 3.87Å; I54-Y76 HydrophobicContact CG1-CE1 3.42Å; I54-Y76 VanDerWaalsContact CG1-CE1 3.42Å; I54-I77 WeakPolarHBondContact O-CD1 3.31Å
55	N	77.5	Confident	71.3	Confident	84 Å²	84	116.8 Å²	116.8	45%	0.449	59%	0.586	S	S	.	*			trans	-80.3	115.3	173.6	-179.7	-4.5	0	0	0	109.4	Y57 F58 Y59	N55-Y57 PolarHBondContact O-N 2.84Å; N55-Y57 PolarHBondContact OD1-N 3.09Å; N55-F58 HydrophobicContact CB-CB 3.94Å; N55-F58 PolarHBondContact O-N 3.27Å; N55-F58 VanDerWaalsContact O-N 3.12Å; N55-Y59 WeakPolarHBondContact O-CE2 3.46Å
56	P	69.5	Low	70.6	Confident	42 Å²	42	116.6 Å²	116.6	27%	0.273	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.6	-15.4	-178.1	24.2	-29.6	0	0	0	113.5	I54 Y59 I77	I54-P56 WeakPolarHBondContact O-CD 3.36Å; P56-Y59 VanDerWaalsContact C-CE2 3.45Å; P56-Y59 WeakPolarHBondContact O-CD2 3.35Å; P56-Y59 WeakPolarHBondContact O-CE2 3.44Å; P56-I77 HydrophobicContact CB-CD1 3.68Å; P56-I77 HydrophobicContact CG-CD1 3.68Å
57	Y	67.7	Low	69.9	Low	209 Å²	209	121.8 Å²	121.8	82%	0.82	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-0.6	-177.7	-57	-70.6	0	0	0	114	N55 Y59	N55-Y57 PolarHBondContact O-N 2.84Å; N55-Y57 PolarHBondContact OD1-N 3.09Å; Y57-Y59 PolarHBondContact O-N 3.44Å
58	F	65	Low	68.9	Low	177 Å²	177	119 Å²	119	78%	0.776	62%	0.62	S	S	*	*			trans	-102.1	58.2	-178.9	-157.5	-96.3	0	0	0	111.9	N55	N55-F58 HydrophobicContact CB-CB 3.94Å; N55-F58 PolarHBondContact O-N 3.27Å; N55-F58 VanDerWaalsContact O-N 3.12Å
59	Y	58	Low	67.9	Low	65 Å²	65	122.7 Å²	122.7	26%	0.255	63%	0.629	S	S	.	*			trans	-117.7	104	179.4	-67.6	-87.6	0	0	0	111.3	I54 N55 P56 Y57 A73	I54-Y59 WeakPolarHBondContact CG2-OH 3.36Å; N55-Y59 WeakPolarHBondContact O-CE2 3.46Å; P56-Y59 VanDerWaalsContact C-CE2 3.45Å; P56-Y59 WeakPolarHBondContact O-CD2 3.35Å; P56-Y59 WeakPolarHBondContact O-CE2 3.44Å; Y57-Y59 PolarHBondContact O-N 3.44Å; Y59-A73 HydrophobicContact CD2-CB 4.12Å; Y59-A73 HydrophobicContact CE1-CB 3.88Å; Y59-A73 HydrophobicContact CE2-CB 3.19Å; Y59-A73 WeakPolarHBondContact OH-CA 3.27Å; Y59-A73 WeakPolarHBondContact OH-CB 3.3Å
60	S	57.2	Low	66.8	Low	81 Å²	81	121.8 Å²	121.8	57%	0.566	63%	0.628	S	S	*	*			trans	54.7	151.8	173.1	84	0	0	0	0	116.2	Q62	S60-Q62 PolarHBondContact O-N 2.91Å; S60-Q62 PolarHBondContact OG-N 3.1Å
61	K	61.5	Low	66.3	Low	223 Å²	223	122.9 Å²	122.9	97%	0.97	64%	0.635	S	S	*	*	S	Bend	trans	-70.6	8.3	174.1	-66.9	-177	178.5	-180	0	113
62	Q	63.6	Low	66.1	Low	152 Å²	152	127.3 Å²	127.3	71%	0.71	66%	0.656	S	S	*	*	S	Bend	trans	-100.8	132.5	-174	-65.7	174.1	-22.5	0	0	109.4	S60 K64	S60-Q62 PolarHBondContact O-N 2.91Å; S60-Q62 PolarHBondContact OG-N 3.1Å; Q62-K64 PolarHBondContact O-N 3.17Å
63	A	62.5	Low	65.6	Low	101 Å²	101	122.7 Å²	122.7	84%	0.835	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-58.8	120.5	171.4	0	0	0	0	0	109
64	K	57.2	Low	65.3	Low	119 Å²	119	116.2 Å²	116.2	52%	0.517	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-88.1	133.9	171.2	-67.2	-173.7	178.4	-172.4	0	109	Q62	Q62-K64 PolarHBondContact O-N 3.17Å
65	N	62.4	Low	65.4	Low	147 Å²	147	115.8 Å²	115.8	79%	0.786	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-64.4	137	168.8	-67.4	-15.7	0	0	0	108.9	L67	N65-L67 PolarHBondContact O-N 3.45Å
66	M	57.7	Low	65.9	Low	192 Å²	192	114.4 Å²	114.4	95%	0.946	60%	0.598	S	S	*	*	S	Bend	trans	-63.1	26.7	-175	-82.2	-159.6	-58.6	0	0	116	A68	M66-A68 VanDerWaalsContact C-N 3.31Å; M66-A68 PolarHBondContact O-N 3.01Å
67	L	58	Low	66.7	Low	153 Å²	153	114.3 Å²	114.3	80%	0.801	60%	0.595	S	S	*	*			trans	-82.2	84.9	171.2	-82.8	157.2	0	0	0	108.7	N65 E69	N65-L67 PolarHBondContact O-N 3.45Å; L67-E69 PolarHBondContact O-N 3.38Å
68	A	54.7	Low	67.7	Low	100 Å²	100	109.8 Å²	109.8	83%	0.826	58%	0.58	S	S	*	*			trans	-74.4	62.2	-177.7	0	0	0	0	0	112.7	M66	M66-A68 VanDerWaalsContact C-N 3.31Å; M66-A68 PolarHBondContact O-N 3.01Å
69	E	56.7	Low	68.9	Low	166 Å²	166	106.5 Å²	106.5	78%	0.776	57%	0.568	S	S	*	*	S	Bend	trans	-84.9	136.6	158.1	-66.4	-169.1	-179.8	0	0	108.5	L67 T71	L67-E69 PolarHBondContact O-N 3.38Å; E69-T71 PolarHBondContact O-N 3.16Å
70	T	58.2	Low	70.4	Confident	106 Å²	106	105.9 Å²	105.9	65%	0.65	57%	0.565	S	S	*	*			trans	-29.5	93	-174.2	-43.8	0	0	0	0	111.7	D72 N75	T70-D72 PolarHBondContact O-N 3.11Å; T70-N75 HydrophobicContact CG2-CB 3.86Å
71	T	68.4	Low	72	Confident	58 Å²	58	104.4 Å²	104.4	36%	0.356	56%	0.558	S	S	.	*			trans	-55.6	141.7	176.6	42.1	0	0	0	0	107.4	E69 A73 S74 N75	E69-T71 PolarHBondContact O-N 3.16Å; T71-A73 CarbonylContact O-C 3.49Å; T71-A73 PolarHBondContact O-N 2.98Å; T71-S74 WeakPolarHBondContact O-CA 3.44Å; T71-S74 PolarHBondContact O-N 3.37Å; T71-N75 PolarHBondContact O-N 3Å; T71-N75 VanDerWaalsContact O-N 3.09Å
72	D	77.7	Confident	73.5	Confident	137 Å²	137	96.3 Å²	96.3	73%	0.733	53%	0.525	S	S	*	.	H	α-helix	trans	-44.9	-36	176.2	-172.1	31.5	0	0	0	111.4	T70 Y76	T70-D72 PolarHBondContact O-N 3.11Å; D72-Y76 WeakPolarHBondContact O-CB 3.44Å; D72-Y76 PolarHBondContact O-N 2.69Å
73	A	76.9	Confident	74.7	Confident	2 Å²	2	92.4 Å²	92.4	2%	0.017	51%	0.506	C	S	.	.	H	α-helix	trans	-46	-58.2	164.9	0	0	0	0	0	117.2	Y59 T71 Y76 I77	Y59-A73 HydrophobicContact CD2-CB 4.12Å; Y59-A73 HydrophobicContact CE1-CB 3.88Å; Y59-A73 HydrophobicContact CE2-CB 3.19Å; Y59-A73 WeakPolarHBondContact OH-CA 3.27Å; Y59-A73 WeakPolarHBondContact OH-CB 3.3Å; T71-A73 CarbonylContact O-C 3.49Å; T71-A73 PolarHBondContact O-N 2.98Å; A73-Y76 PolarHBondContact O-N 3.37Å; A73-I77 WeakPolarHBondContact O-CD1 3.46Å; A73-I77 VanDerWaalsContact O-CG1 3.27Å; A73-I77 WeakPolarHBondContact O-CG1 3.38Å; A73-I77 PolarHBondContact O-N 3.12Å
74	S	79.9	Confident	76	Confident	58 Å²	58	90.9 Å²	90.9	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-71.1	-39.7	-175.9	-172.8	0	0	0	0	110.1	T71 I77 H78	T71-S74 WeakPolarHBondContact O-CA 3.44Å; T71-S74 PolarHBondContact O-N 3.37Å; S74-I77 PolarHBondContact O-N 2.92Å; S74-H78 WeakPolarHBondContact O-CB 3.23Å; S74-H78 PolarHBondContact O-N 2.83Å
75	N	83.9	Confident	77.6	Confident	60 Å²	60	88.9 Å²	88.9	32%	0.321	48%	0.478	S	S	.	.	H	α-helix	trans	-59.6	-49	173.7	-172.6	49.1	0	0	0	110.4	T70 T71 I77 H78 E79	T70-N75 HydrophobicContact CG2-CB 3.86Å; T71-N75 PolarHBondContact O-N 3Å; T71-N75 VanDerWaalsContact O-N 3.09Å; N75-I77 VanDerWaalsContact C-N 3.34Å; N75-I77 PolarHBondContact O-N 3.24Å; N75-H78 WeakPolarHBondContact O-CB 3.48Å; N75-H78 PolarHBondContact O-N 3Å; N75-H78 VanDerWaalsContact O-N 3.09Å; N75-E79 PolarHBondContact ND2-OE1 3.15Å; N75-E79 WeakPolarHBondContact O-CG 3.46Å; N75-E79 PolarHBondContact O-N 3.34Å
76	Y	86.5	Confident	79	Confident	55 Å²	55	90 Å²	90	22%	0.216	47%	0.471	C	S	.	.	H	α-helix	trans	-55.9	-44.2	176.1	173.6	-88	0	0	0	113.1	P51 P52 I54 D72 A73 H78 E79 R80	P51-Y76 HydrophobicContact CB-CE2 4.42Å; P51-Y76 WeakPolarHBondContact CB-OH 3.49Å; P52-Y76 WeakPolarHBondContact CD-OH 3.38Å; P52-Y76 WeakPolarHBondContact O-CE1 3.49Å; P52-Y76 VanDerWaalsContact O-CZ 3.3Å; P52-Y76 PolarHBondContact O-OH 3.1Å; I54-Y76 HydrophobicContact CB-CD1 4.15Å; I54-Y76 HydrophobicContact CB-CE1 4.05Å; I54-Y76 HydrophobicContact CD1-CD1 3.53Å; I54-Y76 HydrophobicContact CD1-CD2 4.21Å; I54-Y76 HydrophobicContact CD1-CE1 3.36Å; I54-Y76 HydrophobicContact CD1-CE2 4.04Å; I54-Y76 HydrophobicContact CD1-CG 3.95Å; I54-Y76 HydrophobicContact CG1-CD1 3.87Å; I54-Y76 HydrophobicContact CG1-CE1 3.42Å; I54-Y76 VanDerWaalsContact CG1-CE1 3.42Å; D72-Y76 WeakPolarHBondContact O-CB 3.44Å; D72-Y76 PolarHBondContact O-N 2.69Å; A73-Y76 PolarHBondContact O-N 3.37Å; Y76-H78 VanDerWaalsContact C-N 3.33Å; Y76-H78 PolarHBondContact O-N 3.46Å; Y76-E79 PolarHBondContact O-N 2.88Å; Y76-R80 VanDerWaalsContact O-CB 3.26Å; Y76-R80 WeakPolarHBondContact O-CB 3.42Å; Y76-R80 PolarHBondContact O-N 2.99Å
77	I	86.6	Confident	80.5	Confident	40 Å²	40	81.9 Å²	81.9	21%	0.205	43%	0.433	C	S	.	.	H	α-helix	trans	-64.7	-39.6	178	-68.6	162.3	0	0	0	111	I54 P56 A73 S74 N75 A81	I54-I77 WeakPolarHBondContact O-CD1 3.31Å; P56-I77 HydrophobicContact CB-CD1 3.68Å; P56-I77 HydrophobicContact CG-CD1 3.68Å; A73-I77 WeakPolarHBondContact O-CD1 3.46Å; A73-I77 VanDerWaalsContact O-CG1 3.27Å; A73-I77 WeakPolarHBondContact O-CG1 3.38Å; A73-I77 PolarHBondContact O-N 3.12Å; S74-I77 PolarHBondContact O-N 2.92Å; N75-I77 VanDerWaalsContact C-N 3.34Å; N75-I77 PolarHBondContact O-N 3.24Å; I77-A81 PolarHBondContact O-N 3.32Å
78	H	88.9	Confident	82	Confident	113 Å²	113	77.4 Å²	77.4	52%	0.523	41%	0.408	S	S	.	.	H	α-helix	trans	-66.8	-46.2	177.8	-171.4	69.8	0	0	0	111.6	S74 N75 Y76 R80 A81 N82	S74-H78 WeakPolarHBondContact O-CB 3.23Å; S74-H78 PolarHBondContact O-N 2.83Å; N75-H78 WeakPolarHBondContact O-CB 3.48Å; N75-H78 PolarHBondContact O-N 3Å; N75-H78 VanDerWaalsContact O-N 3.09Å; Y76-H78 VanDerWaalsContact C-N 3.33Å; Y76-H78 PolarHBondContact O-N 3.46Å; H78-R80 VanDerWaalsContact C-N 3.33Å; H78-R80 PolarHBondContact O-N 3.45Å; H78-A81 PolarHBondContact O-N 2.95Å; H78-N82 PolarHBondContact CD2-ND2 3.41Å; H78-N82 PolarHBondContact NE2-ND2 2.89Å; H78-N82 PolarHBondContact O-N 2.89Å; H78-N82 PolarHBondContact O-ND2 3.36Å
79	E	89.8	Confident	83.7	Confident	109 Å²	109	79.6 Å²	79.6	51%	0.509	40%	0.396	S	S	.	.	H	α-helix	trans	-59.2	-43.3	174.5	-73.1	179.8	-178.8	0	0	111.9	N75 Y76 A81 N82 H83	N75-E79 PolarHBondContact ND2-OE1 3.15Å; N75-E79 WeakPolarHBondContact O-CG 3.46Å; N75-E79 PolarHBondContact O-N 3.34Å; Y76-E79 PolarHBondContact O-N 2.88Å; E79-A81 PolarHBondContact O-N 3.33Å; E79-N82 PolarHBondContact O-N 3.38Å; E79-H83 WeakPolarHBondContact O-CB 3.44Å; E79-H83 PolarHBondContact O-N 2.94Å
80	R	90.5	Very high	85.2	Confident	51 Å²	51	75.9 Å²	75.9	19%	0.192	38%	0.382	C	S	.	.	H	α-helix	trans	-58.4	-45.8	173.8	175	-175.1	-173.2	-65.2	-17	112.1	P51 Y76 H78 H83 M84	P51-R80 HydrophobicContact CG-CB 4.11Å; P51-R80 HydrophobicContact CG-CG 4Å; P51-R80 VanDerWaalsContact O-CD 3.28Å; P51-R80 WeakPolarHBondContact O-CD 3.35Å; P51-R80 PolarHBondContact O-NE 2.97Å; Y76-R80 VanDerWaalsContact O-CB 3.26Å; Y76-R80 WeakPolarHBondContact O-CB 3.42Å; Y76-R80 PolarHBondContact O-N 2.99Å; H78-R80 VanDerWaalsContact C-N 3.33Å; H78-R80 PolarHBondContact O-N 3.45Å; R80-H83 PolarHBondContact O-N 2.67Å; R80-M84 PolarHBondContact NH1-SD 3.39Å; R80-M84 WeakPolarHBondContact O-CG 3.25Å; R80-M84 PolarHBondContact O-N 3.39Å
81	A	90.2	Very high	86.5	Confident	50 Å²	50	72.8 Å²	72.8	41%	0.413	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-43.5	178.5	0	0	0	0	0	111.3	I77 H78 E79 H83 M84 L85	I77-A81 PolarHBondContact O-N 3.32Å; H78-A81 PolarHBondContact O-N 2.95Å; E79-A81 PolarHBondContact O-N 3.33Å; A81-H83 PolarHBondContact O-N 2.87Å; A81-M84 PolarHBondContact O-N 3.25Å; A81-L85 WeakPolarHBondContact O-CB 3.43Å; A81-L85 PolarHBondContact O-N 2.93Å
82	N	92.5	Very high	87.4	Confident	53 Å²	53	74.5 Å²	74.5	28%	0.283	36%	0.358	S	S	.	.	H	α-helix	trans	-62.6	-40.6	175.6	-73.3	-29.2	0	0	0	112.2	H78 E79 L85 R86	H78-N82 PolarHBondContact CD2-ND2 3.41Å; H78-N82 PolarHBondContact NE2-ND2 2.89Å; H78-N82 PolarHBondContact O-N 2.89Å; H78-N82 PolarHBondContact O-ND2 3.36Å; E79-N82 PolarHBondContact O-N 3.38Å; N82-L85 PolarHBondContact O-N 2.94Å; N82-R86 WeakPolarHBondContact O-CB 3.47Å; N82-R86 VanDerWaalsContact O-CG 3.25Å; N82-R86 WeakPolarHBondContact O-CG 3.45Å; N82-R86 PolarHBondContact O-N 3.43Å
83	H	90.1	Very high	87.9	Confident	70 Å²	70	72.7 Å²	72.7	32%	0.324	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-51.6	173.9	178.4	-72.8	0	0	0	111	E79 R80 A81 L85 R86 S87	E79-H83 WeakPolarHBondContact O-CB 3.44Å; E79-H83 PolarHBondContact O-N 2.94Å; R80-H83 PolarHBondContact O-N 2.67Å; A81-H83 PolarHBondContact O-N 2.87Å; H83-L85 VanDerWaalsContact C-N 3.29Å; H83-L85 PolarHBondContact O-N 3.41Å; H83-R86 PolarHBondContact O-N 3.01Å; H83-S87 PolarHBondContact O-N 3.2Å; H83-S87 PolarHBondContact O-OG 3.41Å
84	M	89.1	Confident	88.3	Confident	69 Å²	69	78.5 Å²	78.5	34%	0.34	37%	0.372	S	S	.	.	H	α-helix	trans	-58.2	-42.4	178.2	-71.7	-178.4	65.1	0	0	112.2	P50 R80 A81 S87 E88	P50-M84 HydrophobicContact CB-CG 3.66Å; P50-M84 HydrophobicContact CB-SD 4.09Å; P50-M84 HydrophobicContact CG-CG 4.43Å; R80-M84 PolarHBondContact NH1-SD 3.39Å; R80-M84 WeakPolarHBondContact O-CG 3.25Å; R80-M84 PolarHBondContact O-N 3.39Å; A81-M84 PolarHBondContact O-N 3.25Å; M84-S87 PolarHBondContact O-N 3.45Å; M84-E88 WeakPolarHBondContact O-CG 3.36Å; M84-E88 PolarHBondContact O-N 3.04Å
85	L	91.6	Very high	88.4	Confident	78 Å²	78	77 Å²	77	41%	0.408	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-43.6	178.4	-176.6	62.9	0	0	0	112	A81 N82 H83 E88 Y89	A81-L85 WeakPolarHBondContact O-CB 3.43Å; A81-L85 PolarHBondContact O-N 2.93Å; N82-L85 PolarHBondContact O-N 2.94Å; H83-L85 VanDerWaalsContact C-N 3.29Å; H83-L85 PolarHBondContact O-N 3.41Å; L85-E88 WeakPolarHBondContact O-CB 3.32Å; L85-E88 PolarHBondContact O-N 2.95Å; L85-Y89 HydrophobicContact CD1-CD2 4.42Å; L85-Y89 HydrophobicContact CD1-CE1 4.12Å; L85-Y89 HydrophobicContact CD1-CE2 3.81Å; L85-Y89 HydrophobicContact CD2-CE2 3.88Å; L85-Y89 HydrophobicContact CG-CD2 4.05Å; L85-Y89 HydrophobicContact CG-CE2 3.52Å; L85-Y89 WeakPolarHBondContact O-CD2 3.36Å; L85-Y89 PolarHBondContact O-N 3Å
86	R	91.7	Very high	88.4	Confident	169 Å²	169	78.2 Å²	78.2	64%	0.638	36%	0.358	S	S	*	.	H	α-helix	trans	-61	-46.7	175.1	-71.7	170.9	-170.9	-176.3	3.4	111.1	N82 H83 E88 Y89 D90	N82-R86 WeakPolarHBondContact O-CB 3.47Å; N82-R86 VanDerWaalsContact O-CG 3.25Å; N82-R86 WeakPolarHBondContact O-CG 3.45Å; N82-R86 PolarHBondContact O-N 3.43Å; H83-R86 PolarHBondContact O-N 3.01Å; R86-E88 VanDerWaalsContact C-N 3.29Å; R86-E88 PolarHBondContact O-N 3.39Å; R86-Y89 PolarHBondContact O-N 3.39Å; R86-Y89 VanDerWaalsContact O-N 3.16Å; R86-D90 WeakPolarHBondContact O-CB 3.38Å; R86-D90 VanDerWaalsContact O-CG 3.29Å; R86-D90 PolarHBondContact O-N 3.28Å
87	S	89.1	Confident	88.6	Confident	23 Å²	23	76.8 Å²	76.8	16%	0.161	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-37.5	176.9	-53.9	0	0	0	0	112.7	H83 M84 R91	H83-S87 PolarHBondContact O-N 3.2Å; H83-S87 PolarHBondContact O-OG 3.41Å; M84-S87 PolarHBondContact O-N 3.45Å; S87-R91 WeakPolarHBondContact O-CB 3.41Å; S87-R91 PolarHBondContact O-N 2.97Å
88	E	88.2	Confident	88.6	Confident	58 Å²	58	78 Å²	78	27%	0.271	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-48.5	173	-77.1	-75.4	155.1	0	0	111.3	Y46 M84 L85 R86 D90 R91 Y92	Y46-E88 WeakPolarHBondContact OH-CG 3.28Å; Y46-E88 PolarHBondContact OH-OE1 2.94Å; M84-E88 WeakPolarHBondContact O-CG 3.36Å; M84-E88 PolarHBondContact O-N 3.04Å; L85-E88 WeakPolarHBondContact O-CB 3.32Å; L85-E88 PolarHBondContact O-N 2.95Å; R86-E88 VanDerWaalsContact C-N 3.29Å; R86-E88 PolarHBondContact O-N 3.39Å; E88-D90 VanDerWaalsContact C-N 3.32Å; E88-D90 PolarHBondContact O-N 3.36Å; E88-R91 WeakPolarHBondContact O-CB 3.18Å; E88-R91 PolarHBondContact O-N 3.3Å; E88-R91 VanDerWaalsContact O-N 3.1Å; E88-R91 IonicContact OE1-CZ 2.77Å; E88-R91 IonicContact OE1-NH1 3.72Å; E88-R91 PolarHBondContact OE1-NH1 2.68Å; E88-R91 IonicContact OE1-NH2 3.91Å; E88-R91 IonicContact OE2-CZ 3.02Å; E88-R91 IonicContact OE2-NE 3.76Å; E88-R91 IonicContact OE2-NH1 3.53Å; E88-R91 PolarHBondContact OE2-NH1 3.46Å; E88-R91 IonicContact OE2-NH2 3.7Å; E88-R91 PolarHBondContact OE2-NH2 3.42Å; E88-Y92 VanDerWaalsContact O-CD2 3.29Å; E88-Y92 WeakPolarHBondContact O-CD2 3.41Å; E88-Y92 PolarHBondContact O-N 3.17Å
89	Y	90.9	Very high	88.5	Confident	147 Å²	147	77.4 Å²	77.4	58%	0.576	36%	0.357	S	S	*	.	H	α-helix	trans	-59.2	-43.5	176.2	-70.4	-34.7	0	0	0	112.3	L85 R86 R91 Y92 H93	L85-Y89 HydrophobicContact CD1-CD2 4.42Å; L85-Y89 HydrophobicContact CD1-CE1 4.12Å; L85-Y89 HydrophobicContact CD1-CE2 3.81Å; L85-Y89 HydrophobicContact CD2-CE2 3.88Å; L85-Y89 HydrophobicContact CG-CD2 4.05Å; L85-Y89 HydrophobicContact CG-CE2 3.52Å; L85-Y89 WeakPolarHBondContact O-CD2 3.36Å; L85-Y89 PolarHBondContact O-N 3Å; R86-Y89 PolarHBondContact O-N 3.39Å; R86-Y89 VanDerWaalsContact O-N 3.16Å; Y89-R91 VanDerWaalsContact C-N 3.32Å; Y89-R91 PolarHBondContact O-N 3.03Å; Y89-Y92 PolarHBondContact O-N 2.94Å; Y89-H93 WeakPolarHBondContact O-CB 3.47Å; Y89-H93 PolarHBondContact O-N 2.8Å
90	D	88.5	Confident	88.6	Confident	88 Å²	88	78 Å²	78	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-44	174.5	-69.5	-27	0	0	0	110.4	R86 E88 Y92 H93 H94	R86-D90 WeakPolarHBondContact O-CB 3.38Å; R86-D90 VanDerWaalsContact O-CG 3.29Å; R86-D90 PolarHBondContact O-N 3.28Å; E88-D90 VanDerWaalsContact C-N 3.32Å; E88-D90 PolarHBondContact O-N 3.36Å; D90-Y92 PolarHBondContact O-N 3.27Å; D90-H93 PolarHBondContact O-N 3.14Å; D90-H94 WeakPolarHBondContact O-CB 3.48Å; D90-H94 PolarHBondContact O-N 3.35Å; D90-H94 PolarHBondContact O-ND1 2.89Å
91	R	85.7	Confident	88.8	Confident	40 Å²	40	84 Å²	84	15%	0.151	38%	0.382	C	S	.	.	H	α-helix	trans	-57.5	-49.7	176.7	-172.3	-172.3	77.5	-159.7	4	112.1	P41 V44 Y46 S87 E88 Y89 Y95	P41-R91 HydrophobicContact CG-CG 4.27Å; V44-R91 HydrophobicContact CG2-CG 4.05Å; Y46-R91 PolarHBondContact OH-NH1 3.04Å; S87-R91 WeakPolarHBondContact O-CB 3.41Å; S87-R91 PolarHBondContact O-N 2.97Å; E88-R91 WeakPolarHBondContact O-CB 3.18Å; E88-R91 PolarHBondContact O-N 3.3Å; E88-R91 VanDerWaalsContact O-N 3.1Å; E88-R91 IonicContact OE1-CZ 2.77Å; E88-R91 IonicContact OE1-NH1 3.72Å; E88-R91 PolarHBondContact OE1-NH1 2.68Å; E88-R91 IonicContact OE1-NH2 3.91Å; E88-R91 IonicContact OE2-CZ 3.02Å; E88-R91 IonicContact OE2-NE 3.76Å; E88-R91 IonicContact OE2-NH1 3.53Å; E88-R91 PolarHBondContact OE2-NH1 3.46Å; E88-R91 IonicContact OE2-NH2 3.7Å; E88-R91 PolarHBondContact OE2-NH2 3.42Å; Y89-R91 VanDerWaalsContact C-N 3.32Å; Y89-R91 PolarHBondContact O-N 3.03Å; R91-Y95 PolarHBondContact O-N 3.47Å
92	Y	86.7	Confident	88.7	Confident	94 Å²	94	82.1 Å²	82.1	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-64.7	-45.1	178.1	-83.9	-86.1	0	0	0	111.4	P41 E88 Y89 D90 Y95 Y96	P41-Y92 VanDerWaalsContact CD-CD1 3.44Å; P41-Y92 HydrophobicContact CG-CD1 3.83Å; P41-Y92 HydrophobicContact CG-CD2 4.38Å; P41-Y92 HydrophobicContact CG-CE1 3.84Å; P41-Y92 HydrophobicContact CG-CE2 4.36Å; P41-Y92 HydrophobicContact CG-CG 4.1Å; E88-Y92 VanDerWaalsContact O-CD2 3.29Å; E88-Y92 WeakPolarHBondContact O-CD2 3.41Å; E88-Y92 PolarHBondContact O-N 3.17Å; Y89-Y92 PolarHBondContact O-N 2.94Å; D90-Y92 PolarHBondContact O-N 3.27Å; Y92-Y95 PolarHBondContact O-N 3Å; Y92-Y96 HydrophobicContact CD1-CE2 4.14Å; Y92-Y96 VanDerWaalsContact O-CD2 3.31Å; Y92-Y96 WeakPolarHBondContact O-CD2 3.43Å; Y92-Y96 PolarHBondContact O-N 3.5Å; Y92-Y96 VanDerWaalsContact O-N 3.11Å
93	H	89.5	Confident	88.8	Confident	99 Å²	99	85 Å²	85	46%	0.458	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-52.6	179.9	-178.7	76.6	0	0	0	111.1	Y89 D90 Y95 Y96 S97 Y101	Y89-H93 WeakPolarHBondContact O-CB 3.47Å; Y89-H93 PolarHBondContact O-N 2.8Å; D90-H93 PolarHBondContact O-N 3.14Å; H93-Y95 PolarHBondContact O-N 3.26Å; H93-Y96 PolarHBondContact O-N 3.42Å; H93-S97 WeakPolarHBondContact O-CA 3.34Å; H93-S97 WeakPolarHBondContact O-CB 3.36Å; H93-S97 PolarHBondContact O-N 3.46Å; H93-Y101 AromaticContact CE1-CE2 3.73Å
94	H	84.9	Confident	89	Confident	124 Å²	124	88.5 Å²	88.5	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-55.6	-38.5	178	-77.6	83.3	0	0	0	111.5	D90 S97	D90-H94 WeakPolarHBondContact O-CB 3.48Å; D90-H94 PolarHBondContact O-N 3.35Å; D90-H94 PolarHBondContact O-ND1 2.89Å; H94-S97 PolarHBondContact O-OG 2.86Å
95	Y	81.8	Confident	89.2	Confident	26 Å²	26	94.4 Å²	94.4	10%	0.102	42%	0.42	C	S	.	.	H	α-helix	trans	-68.6	-45	-179	-156	-66.8	0	0	0	112.8	R34 Y40 P41 P42 R91 Y92 H93 Y110	R34-Y95 PolarHBondContact NH1-OH 2.84Å; R34-Y95 VanDerWaalsContact NH1-OH 3.14Å; Y40-Y95 AromaticContact CD2-CE1 3.93Å; Y40-Y95 HydrophobicContact CD2-CE1 3.93Å; Y40-Y95 AromaticContact CE1-CD1 3.64Å; Y40-Y95 HydrophobicContact CE1-CD1 3.64Å; Y40-Y95 AromaticContact CE1-CE1 3.85Å; Y40-Y95 HydrophobicContact CE1-CE1 3.85Å; Y40-Y95 HydrophobicContact CE1-CG 4.33Å; Y40-Y95 AromaticContact CE2-CD1 3.73Å; Y40-Y95 HydrophobicContact CE2-CD1 3.73Å; Y40-Y95 AromaticContact CE2-CE1 3.03Å; Y40-Y95 HydrophobicContact CE2-CE1 3.03Å; Y40-Y95 AromaticContact CE2-CZ 3.53Å; Y40-Y95 AromaticContact CZ-CD1 3.16Å; Y40-Y95 AromaticContact CZ-CE1 3Å; Y40-Y95 AromaticContact CZ-CZ 3.89Å; Y40-Y95 WeakPolarHBondContact OH-CD1 3.35Å; Y40-Y95 WeakPolarHBondContact OH-CE1 3.44Å; P41-Y95 HydrophobicContact CB-CD2 3.4Å; P41-Y95 HydrophobicContact CB-CE2 3.98Å; P41-Y95 HydrophobicContact CB-CG 3.78Å; P42-Y95 VanDerWaalsContact CD-CE2 3.48Å; P42-Y95 HydrophobicContact CG-CE2 4.34Å; R91-Y95 PolarHBondContact O-N 3.47Å; Y92-Y95 PolarHBondContact O-N 3Å; H93-Y95 PolarHBondContact O-N 3.26Å; Y95-Y110 HydrophobicContact CE1-CE2 4.33Å
96	Y	84.6	Confident	89.1	Confident	87 Å²	87	93.9 Å²	93.9	34%	0.341	42%	0.415	S	S	.	.	H	α-helix	trans	-84.9	-11.7	178.2	-67.4	-72.4	0	0	0	113.5	Y40 Y92 H93 N98 Y99 F100	Y40-Y96 HydrophobicContact CD1-CE1 4.39Å; Y40-Y96 HydrophobicContact CD1-CE2 4.43Å; Y40-Y96 AromaticContact CD1-CZ 3.85Å; Y40-Y96 VanDerWaalsContact CD1-OH 3.3Å; Y40-Y96 WeakPolarHBondContact CD1-OH 3.34Å; Y40-Y96 HydrophobicContact CE1-CD1 4.16Å; Y40-Y96 HydrophobicContact CE1-CD2 4.44Å; Y40-Y96 AromaticContact CE1-CE1 3.35Å; Y40-Y96 HydrophobicContact CE1-CE1 3.35Å; Y40-Y96 AromaticContact CE1-CE2 3.71Å; Y40-Y96 HydrophobicContact CE1-CE2 3.71Å; Y40-Y96 AromaticContact CE1-CZ 3.11Å; Y40-Y96 WeakPolarHBondContact CE1-OH 3.4Å; Y40-Y96 AromaticContact CZ-CE1 3.64Å; Y40-Y96 AromaticContact CZ-CZ 3.91Å; Y40-Y96 WeakPolarHBondContact OH-CD1 3.23Å; Y40-Y96 WeakPolarHBondContact OH-CE1 3.34Å; Y92-Y96 HydrophobicContact CD1-CE2 4.14Å; Y92-Y96 VanDerWaalsContact O-CD2 3.31Å; Y92-Y96 WeakPolarHBondContact O-CD2 3.43Å; Y92-Y96 PolarHBondContact O-N 3.5Å; Y92-Y96 VanDerWaalsContact O-N 3.11Å; H93-Y96 PolarHBondContact O-N 3.42Å; Y96-N98 VanDerWaalsContact C-N 3.29Å; Y96-N98 PolarHBondContact O-N 3.27Å; Y96-Y99 WeakPolarHBondContact O-CB 3.48Å; Y96-Y99 PolarHBondContact O-N 2.86Å; Y96-F100 WeakPolarHBondContact O-CD2 3.5Å; Y96-F100 PolarHBondContact O-N 3.41Å
97	S	89.2	Confident	89.1	Confident	25 Å²	25	88.1 Å²	88.1	18%	0.175	39%	0.394	C	S	.	.	H	α-helix	trans	-56.1	-44.2	-176.6	67.7	0	0	0	0	111.4	H93 H94 Y99 F100 Y101 G102	H93-S97 WeakPolarHBondContact O-CA 3.34Å; H93-S97 WeakPolarHBondContact O-CB 3.36Å; H93-S97 PolarHBondContact O-N 3.46Å; H94-S97 PolarHBondContact O-OG 2.86Å; S97-Y99 PolarHBondContact O-N 3.49Å; S97-Y99 VanDerWaalsContact O-N 3.15Å; S97-F100 PolarHBondContact O-N 3.38Å; S97-F100 VanDerWaalsContact O-N 3.17Å; S97-Y101 WeakPolarHBondContact O-CA 3.34Å; S97-Y101 PolarHBondContact O-N 3.44Å; S97-G102 PolarHBondContact O-N 2.88Å; S97-G102 VanDerWaalsContact O-N 3.13Å
98	N	86.7	Confident	89.3	Confident	64 Å²	64	91 Å²	91	34%	0.342	41%	0.405	S	S	.	.	H	α-helix	trans	-57.7	-32.7	177.9	-68.5	-0.7	0	0	0	112.6	Y96 G102 E106 K107	Y96-N98 VanDerWaalsContact C-N 3.29Å; Y96-N98 PolarHBondContact O-N 3.27Å; N98-G102 WeakPolarHBondContact O-CA 3.47Å; N98-G102 PolarHBondContact O-N 2.87Å; N98-E106 HydrophobicContact CB-CB 4.4Å; N98-K107 WeakPolarHBondContact O-CG 3.47Å
99	Y	88.4	Confident	89.3	Confident	101 Å²	101	91.3 Å²	91.3	40%	0.396	41%	0.409	S	S	.	.	H	α-helix	trans	-74.9	-42.1	179.1	178.4	-105.2	0	0	0	112.6	Y96 S97 K107 Y110	Y96-Y99 WeakPolarHBondContact O-CB 3.48Å; Y96-Y99 PolarHBondContact O-N 2.86Å; S97-Y99 PolarHBondContact O-N 3.49Å; S97-Y99 VanDerWaalsContact O-N 3.15Å; Y99-K107 WeakPolarHBondContact O-CE 3.41Å; Y99-Y110 AromaticContact CD2-CD1 3.51Å; Y99-Y110 HydrophobicContact CD2-CD1 3.51Å; Y99-Y110 AromaticContact CD2-CE1 3.56Å; Y99-Y110 HydrophobicContact CD2-CE1 3.56Å; Y99-Y110 HydrophobicContact CD2-CG 4.49Å; Y99-Y110 HydrophobicContact CE2-CD1 4.42Å; Y99-Y110 HydrophobicContact CE2-CE1 4.32Å; Y99-Y110 HydrophobicContact CG-CD1 4.07Å; Y99-Y110 AromaticContact CG-CE1 3.9Å; Y99-Y110 HydrophobicContact CG-CE1 3.9Å
100	F	90.9	Very high	89.2	Confident	121 Å²	121	86.2 Å²	86.2	53%	0.531	39%	0.389	S	S	.	.	H	α-helix	trans	-88.1	-50.7	-176.9	-68.3	-73.9	0	0	0	112.4	Y96 S97 K107	Y96-F100 WeakPolarHBondContact O-CD2 3.5Å; Y96-F100 PolarHBondContact O-N 3.41Å; S97-F100 PolarHBondContact O-N 3.38Å; S97-F100 VanDerWaalsContact O-N 3.17Å; F100-K107 VanDerWaalsContact O-CE 3.26Å; F100-K107 WeakPolarHBondContact O-CE 3.33Å; F100-K107 PolarHBondContact O-NZ 3.24Å
101	Y	93.7	Very high	89.2	Confident	178 Å²	178	88.2 Å²	88.2	70%	0.698	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-10.2	-168.7	-51.6	-66.4	0	0	0	114.3	H93 S97	H93-Y101 AromaticContact CE1-CE2 3.73Å; S97-Y101 WeakPolarHBondContact O-CA 3.34Å; S97-Y101 PolarHBondContact O-N 3.44Å
102	G	90	Very high	89.4	Confident	10 Å²	10	92.1 Å²	92.1	10%	0.103	41%	0.408	C	S	.	.	S	Bend	trans	-65.7	161.7	-179.6	0	0	0	0	0	114.2	S97 N98 E106 K107	S97-G102 PolarHBondContact O-N 2.88Å; S97-G102 VanDerWaalsContact O-N 3.13Å; N98-G102 WeakPolarHBondContact O-CA 3.47Å; N98-G102 PolarHBondContact O-N 2.87Å; G102-E106 WeakPolarHBondContact CA-OE2 3.31Å; G102-K107 WeakPolarHBondContact O-CD 3.32Å; G102-K107 WeakPolarHBondContact O-CE 3.26Å; G102-K107 PolarHBondContact O-NZ 3.44Å
103	N	94	Very high	89.4	Confident	114 Å²	114	90.6 Å²	90.6	61%	0.61	40%	0.402	S	S	*	.			trans	-64.4	161.6	169.8	-168.7	6.8	0	0	0	110.3	R105 E106 K107	N103-R105 PolarHBondContact O-N 3.35Å; N103-R105 VanDerWaalsContact O-N 3.09Å; N103-E106 PolarHBondContact N-OE2 3.34Å; N103-E106 PolarHBondContact O-N 2.91Å; N103-K107 PolarHBondContact O-N 3.29Å
104	M	93.1	Very high	89.2	Confident	143 Å²	143	89 Å²	89	70%	0.704	40%	0.396	S	S	*	.	H	α-helix	trans	-53.3	-36.1	-179.3	-69.9	-60.5	167.3	0	0	112.9	E108	M104-E108 WeakPolarHBondContact O-CB 3.32Å; M104-E108 PolarHBondContact O-N 2.87Å
105	R	93.6	Very high	89.5	Confident	194 Å²	194	89.7 Å²	89.7	73%	0.732	39%	0.394	S	S	*	.	H	α-helix	trans	-63.2	-47.5	174.6	-174.6	175.4	179.3	175.1	0.9	112.5	N103 K107 E108 D109	N103-R105 PolarHBondContact O-N 3.35Å; N103-R105 VanDerWaalsContact O-N 3.09Å; R105-K107 VanDerWaalsContact C-N 3.35Å; R105-E108 PolarHBondContact O-N 2.99Å; R105-D109 PolarHBondContact O-N 3.37Å
106	E	90.8	Very high	90	Very high	67 Å²	67	92.6 Å²	92.6	31%	0.313	41%	0.408	S	S	.	.	H	α-helix	trans	-67.3	-38.2	-179.5	-63.1	171.8	151.7	0	0	111.6	N98 G102 N103 E108 D109 Y110	N98-E106 HydrophobicContact CB-CB 4.4Å; G102-E106 WeakPolarHBondContact CA-OE2 3.31Å; N103-E106 PolarHBondContact N-OE2 3.34Å; N103-E106 PolarHBondContact O-N 2.91Å; E106-E108 VanDerWaalsContact C-N 3.33Å; E106-D109 PolarHBondContact O-N 3.49Å; E106-Y110 WeakPolarHBondContact O-CB 3.37Å; E106-Y110 PolarHBondContact O-N 3.47Å
107	K	91.2	Very high	90.2	Very high	47 Å²	47	88.7 Å²	88.7	20%	0.204	40%	0.395	C	S	.	.	H	α-helix	trans	-60.4	-43.5	172.6	-73.9	177.4	172.1	171.3	0	111.3	N98 Y99 F100 G102 N103 R105 Y110 R111	N98-K107 WeakPolarHBondContact O-CG 3.47Å; Y99-K107 WeakPolarHBondContact O-CE 3.41Å; F100-K107 VanDerWaalsContact O-CE 3.26Å; F100-K107 WeakPolarHBondContact O-CE 3.33Å; F100-K107 PolarHBondContact O-NZ 3.24Å; G102-K107 WeakPolarHBondContact O-CD 3.32Å; G102-K107 WeakPolarHBondContact O-CE 3.26Å; G102-K107 PolarHBondContact O-NZ 3.44Å; N103-K107 PolarHBondContact O-N 3.29Å; R105-K107 VanDerWaalsContact C-N 3.35Å; K107-Y110 PolarHBondContact O-N 2.84Å; K107-R111 VanDerWaalsContact O-CG 3.32Å; K107-R111 WeakPolarHBondContact O-CG 3.38Å; K107-R111 PolarHBondContact O-N 2.89Å
108	E	92.2	Very high	90.3	Very high	83 Å²	83	92 Å²	92	39%	0.388	41%	0.41	S	S	.	.	H	α-helix	trans	-70.2	-39	177.5	-171.2	56	-153.7	0	0	112.3	M104 R105 E106 Y110 R111 K112 R115	M104-E108 WeakPolarHBondContact O-CB 3.32Å; M104-E108 PolarHBondContact O-N 2.87Å; R105-E108 PolarHBondContact O-N 2.99Å; E106-E108 VanDerWaalsContact C-N 3.33Å; E108-Y110 VanDerWaalsContact C-N 3.31Å; E108-Y110 PolarHBondContact O-N 3.37Å; E108-R111 PolarHBondContact O-N 3.3Å; E108-R111 IonicContact OE2-NH1 2.89Å; E108-K112 VanDerWaalsContact O-CB 3.3Å; E108-K112 WeakPolarHBondContact O-CB 3.4Å; E108-K112 PolarHBondContact O-N 2.98Å; E108-R115 IonicContact OE1-NH2 3.43Å
109	D	89.8	Confident	90.6	Very high	66 Å²	66	93.5 Å²	93.5	35%	0.353	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-41.3	174	-75.1	-29.1	0	0	0	111.6	R105 E106 K112 Y113	R105-D109 PolarHBondContact O-N 3.37Å; E106-D109 PolarHBondContact O-N 3.49Å; D109-K112 PolarHBondContact O-N 3.3Å; D109-Y113 PolarHBondContact O-N 3.48Å
110	Y	87.1	Confident	90.8	Very high	39 Å²	39	91.9 Å²	91.9	15%	0.153	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-46.8	173.4	179.4	-90.1	0	0	0	112	Y40 Y95 Y99 E106 K107 E108 K112 Y113 I114	Y40-Y110 WeakPolarHBondContact OH-CE2 3.45Å; Y40-Y110 PolarHBondContact OH-OH 3.22Å; Y95-Y110 HydrophobicContact CE1-CE2 4.33Å; Y99-Y110 AromaticContact CD2-CD1 3.51Å; Y99-Y110 HydrophobicContact CD2-CD1 3.51Å; Y99-Y110 AromaticContact CD2-CE1 3.56Å; Y99-Y110 HydrophobicContact CD2-CE1 3.56Å; Y99-Y110 HydrophobicContact CD2-CG 4.49Å; Y99-Y110 HydrophobicContact CE2-CD1 4.42Å; Y99-Y110 HydrophobicContact CE2-CE1 4.32Å; Y99-Y110 HydrophobicContact CG-CD1 4.07Å; Y99-Y110 AromaticContact CG-CE1 3.9Å; Y99-Y110 HydrophobicContact CG-CE1 3.9Å; E106-Y110 WeakPolarHBondContact O-CB 3.37Å; E106-Y110 PolarHBondContact O-N 3.47Å; K107-Y110 PolarHBondContact O-N 2.84Å; E108-Y110 VanDerWaalsContact C-N 3.31Å; E108-Y110 PolarHBondContact O-N 3.37Å; Y110-K112 VanDerWaalsContact C-N 3.32Å; Y110-K112 PolarHBondContact O-N 3.36Å; Y110-Y113 WeakPolarHBondContact O-CB 3.3Å; Y110-Y113 PolarHBondContact O-N 3.41Å; Y110-I114 HydrophobicContact CD1-CG1 4.31Å; Y110-I114 HydrophobicContact CE1-CD1 4.47Å; Y110-I114 HydrophobicContact CE1-CG1 3.89Å; Y110-I114 WeakPolarHBondContact O-CG1 3.22Å; Y110-I114 PolarHBondContact O-N 2.95Å; Y110-I114 VanDerWaalsContact O-N 3.08Å
111	R	88.7	Confident	90.8	Very high	131 Å²	131	90.4 Å²	90.4	49%	0.494	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-40.3	176.8	-71.9	170.9	-175.8	176.6	0	112	K107 E108 I114 R115	K107-R111 VanDerWaalsContact O-CG 3.32Å; K107-R111 WeakPolarHBondContact O-CG 3.38Å; K107-R111 PolarHBondContact O-N 2.89Å; E108-R111 PolarHBondContact O-N 3.3Å; E108-R111 IonicContact OE2-NH1 2.89Å; R111-I114 PolarHBondContact O-N 2.96Å; R111-R115 WeakPolarHBondContact O-CB 3.38Å; R111-R115 PolarHBondContact O-N 3.19Å
112	K	90.8	Very high	90.9	Very high	122 Å²	122	87.8 Å²	87.8	53%	0.53	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-45.5	175.4	-177.6	-179	177.1	-176.7	0	110.7	E108 D109 Y110 I114 R115 E116	E108-K112 VanDerWaalsContact O-CB 3.3Å; E108-K112 WeakPolarHBondContact O-CB 3.4Å; E108-K112 PolarHBondContact O-N 2.98Å; D109-K112 PolarHBondContact O-N 3.3Å; Y110-K112 VanDerWaalsContact C-N 3.32Å; Y110-K112 PolarHBondContact O-N 3.36Å; K112-I114 PolarHBondContact O-N 2.9Å; K112-R115 PolarHBondContact O-N 3.44Å; K112-E116 WeakPolarHBondContact O-CG 3.33Å; K112-E116 PolarHBondContact O-N 3.44Å
113	Y	85.8	Confident	91.2	Very high	61 Å²	61	92.4 Å²	92.4	24%	0.239	42%	0.42	C	S	.	.	H	α-helix	trans	-56.5	-48.3	175	169.7	-105	0	0	0	112.3	R34 D109 Y110 R115 E116 G117	R34-Y113 HydrophobicContact CB-CE2 3.7Å; D109-Y113 PolarHBondContact O-N 3.48Å; Y110-Y113 WeakPolarHBondContact O-CB 3.3Å; Y110-Y113 PolarHBondContact O-N 3.41Å; Y113-R115 VanDerWaalsContact C-N 3.34Å; Y113-R115 PolarHBondContact O-N 2.98Å; Y113-E116 PolarHBondContact O-N 3.31Å; Y113-G117 PolarHBondContact O-N 3.2Å
114	I	86.3	Confident	91.2	Very high	66 Å²	66	89 Å²	89	34%	0.338	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-41	177.2	-61.6	-61	0	0	0	111.4	Y110 R111 K112 G117 L118	Y110-I114 HydrophobicContact CD1-CG1 4.31Å; Y110-I114 HydrophobicContact CE1-CD1 4.47Å; Y110-I114 HydrophobicContact CE1-CG1 3.89Å; Y110-I114 WeakPolarHBondContact O-CG1 3.22Å; Y110-I114 PolarHBondContact O-N 2.95Å; Y110-I114 VanDerWaalsContact O-N 3.08Å; R111-I114 PolarHBondContact O-N 2.96Å; K112-I114 PolarHBondContact O-N 2.9Å; I114-G117 WeakPolarHBondContact O-CA 3.48Å; I114-G117 PolarHBondContact O-N 3.39Å; I114-L118 HydrophobicContact CG2-CD1 4.24Å; I114-L118 WeakPolarHBondContact O-CG 3.15Å; I114-L118 PolarHBondContact O-N 3.47Å
115	R	91.2	Very high	91.4	Very high	138 Å²	138	87.7 Å²	87.7	52%	0.521	39%	0.392	S	S	.	.	H	α-helix	trans	-63.6	-46.4	178.9	-167.4	-175.7	-55.2	-177.8	9.7	112.2	E108 R111 K112 Y113 G117 L118 K119	E108-R115 IonicContact OE1-NH2 3.43Å; R111-R115 WeakPolarHBondContact O-CB 3.38Å; R111-R115 PolarHBondContact O-N 3.19Å; K112-R115 PolarHBondContact O-N 3.44Å; Y113-R115 VanDerWaalsContact C-N 3.34Å; Y113-R115 PolarHBondContact O-N 2.98Å; R115-G117 PolarHBondContact O-N 2.93Å; R115-L118 PolarHBondContact O-N 3.5Å; R115-K119 WeakPolarHBondContact O-CG 3.33Å; R115-K119 PolarHBondContact O-N 2.88Å
116	E	91.2	Very high	91.6	Very high	87 Å²	87	84.6 Å²	84.6	41%	0.407	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-36.6	174	-67.2	-52.6	131.1	0	0	111.1	K112 Y113 L118 K119 Q120	K112-E116 WeakPolarHBondContact O-CG 3.33Å; K112-E116 PolarHBondContact O-N 3.44Å; Y113-E116 PolarHBondContact O-N 3.31Å; E116-L118 PolarHBondContact O-N 3.43Å; E116-K119 PolarHBondContact O-N 2.93Å; E116-K119 IonicContact OE1-NZ 2.64Å; E116-K119 PolarHBondContact OE1-NZ 3.38Å; E116-K119 IonicContact OE2-NZ 2.9Å; E116-Q120 PolarHBondContact O-N 2.94Å
117	G	88.9	Confident	91.9	Very high	6 Å²	6	87.3 Å²	87.3	6%	0.062	40%	0.399	C	S	.	.	H	α-helix	trans	-47.5	-59.4	167.8	0	0	0	0	0	114	I36 Y113 I114 R115 Q120 Q121	I36-G117 VanDerWaalsContact CD1-CA 3.45Å; Y113-G117 PolarHBondContact O-N 3.2Å; I114-G117 WeakPolarHBondContact O-CA 3.48Å; I114-G117 PolarHBondContact O-N 3.39Å; R115-G117 PolarHBondContact O-N 2.93Å; G117-Q120 PolarHBondContact O-N 3.36Å; G117-Q121 WeakPolarHBondContact O-CG 3.04Å; G117-Q121 PolarHBondContact O-N 3.48Å; G117-Q121 VanDerWaalsContact O-N 3.09Å
118	L	91.3	Very high	92.2	Very high	93 Å²	93	92.1 Å²	92.1	49%	0.487	42%	0.415	S	S	.	.	H	α-helix	trans	-65.4	-40.2	-178.6	-69.2	169.6	0	0	0	112.2	I114 R115 E116 Q120 Q121 M122	I114-L118 HydrophobicContact CG2-CD1 4.24Å; I114-L118 WeakPolarHBondContact O-CG 3.15Å; I114-L118 PolarHBondContact O-N 3.47Å; R115-L118 PolarHBondContact O-N 3.5Å; E116-L118 PolarHBondContact O-N 3.43Å; L118-Q120 VanDerWaalsContact C-N 3.34Å; L118-Q120 PolarHBondContact O-N 2.94Å; L118-Q121 PolarHBondContact O-N 3.19Å; L118-M122 VanDerWaalsContact O-CG 3.31Å; L118-M122 WeakPolarHBondContact O-CG 3.35Å; L118-M122 PolarHBondContact O-N 3.14Å
119	K	94	Very high	92.5	Very high	96 Å²	96	94 Å²	94	42%	0.417	42%	0.422	S	S	.	.	H	α-helix	trans	-57.7	-47	175.8	-75.2	176.4	-177.3	173.2	0	111.5	R115 E116 M122 M123	R115-K119 WeakPolarHBondContact O-CG 3.33Å; R115-K119 PolarHBondContact O-N 2.88Å; E116-K119 PolarHBondContact O-N 2.93Å; E116-K119 IonicContact OE1-NZ 2.64Å; E116-K119 PolarHBondContact OE1-NZ 3.38Å; E116-K119 IonicContact OE2-NZ 2.9Å; K119-M122 WeakPolarHBondContact O-CB 3.37Å; K119-M122 PolarHBondContact O-N 3.3Å; K119-M123 WeakPolarHBondContact O-CG 3.36Å; K119-M123 PolarHBondContact O-N 2.95Å
120	Q	92.1	Very high	92.9	Very high	67 Å²	67	97.5 Å²	97.5	31%	0.313	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-45.6	177.5	-173.9	60.2	44.7	0	0	111.6	I36 E116 G117 L118 M122 M123 D124	I36-Q120 HydrophobicContact CD1-CB 3.36Å; I36-Q120 HydrophobicContact CD1-CG 3.74Å; E116-Q120 PolarHBondContact O-N 2.94Å; G117-Q120 PolarHBondContact O-N 3.36Å; L118-Q120 VanDerWaalsContact C-N 3.34Å; L118-Q120 PolarHBondContact O-N 2.94Å; Q120-M122 VanDerWaalsContact C-N 3.26Å; Q120-M122 PolarHBondContact O-N 3.22Å; Q120-M123 HydrophobicContact CB-CE 4.46Å; Q120-M123 PolarHBondContact O-N 3.41Å; Q120-M123 VanDerWaalsContact O-N 3.15Å; Q120-D124 VanDerWaalsContact NE2-CG 3.32Å; Q120-D124 PolarHBondContact NE2-OD1 3.45Å; Q120-D124 VanDerWaalsContact NE2-OD1 3.09Å; Q120-D124 PolarHBondContact NE2-OD2 2.86Å; Q120-D124 WeakPolarHBondContact O-CB 3.43Å; Q120-D124 PolarHBondContact O-N 3.05Å
121	Q	91.4	Very high	93.4	Very high	90 Å²	90	99.9 Å²	99.9	42%	0.421	45%	0.447	S	S	.	.	H	α-helix	trans	-59.7	-38	176.5	-70.1	177.2	8	0	0	112.1	I36 G117 L118 K125	I36-Q121 HydrophobicContact CG2-CG 3.98Å; G117-Q121 WeakPolarHBondContact O-CG 3.04Å; G117-Q121 PolarHBondContact O-N 3.48Å; G117-Q121 VanDerWaalsContact O-N 3.09Å; L118-Q121 PolarHBondContact O-N 3.19Å; Q121-K125 VanDerWaalsContact O-CB 3.27Å; Q121-K125 WeakPolarHBondContact O-CB 3.47Å; Q121-K125 PolarHBondContact O-N 3.28Å
122	M	95	Very high	93.8	Very high	123 Å²	123	98.5 Å²	98.5	61%	0.606	45%	0.446	S	S	*	.	H	α-helix	trans	-65.6	-45.4	174.3	-72.4	177.5	67.8	0	0	111.8	L118 K119 Q120 K125 M126	L118-M122 VanDerWaalsContact O-CG 3.31Å; L118-M122 WeakPolarHBondContact O-CG 3.35Å; L118-M122 PolarHBondContact O-N 3.14Å; K119-M122 WeakPolarHBondContact O-CB 3.37Å; K119-M122 PolarHBondContact O-N 3.3Å; Q120-M122 VanDerWaalsContact C-N 3.26Å; Q120-M122 PolarHBondContact O-N 3.22Å; M122-K125 PolarHBondContact O-N 3.46Å; M122-M126 WeakPolarHBondContact O-CG 3.47Å; M122-M126 PolarHBondContact O-N 3.13Å
123	M	96	Very high	94.1	Very high	108 Å²	108	100.8 Å²	100.8	53%	0.532	45%	0.451	S	S	.	.	H	α-helix	trans	-60.5	-45.3	176.2	-71	-170	-61	0	0	111.5	K119 Q120 K125 M126 K127	K119-M123 WeakPolarHBondContact O-CG 3.36Å; K119-M123 PolarHBondContact O-N 2.95Å; Q120-M123 HydrophobicContact CB-CE 4.46Å; Q120-M123 PolarHBondContact O-N 3.41Å; Q120-M123 VanDerWaalsContact O-N 3.15Å; M123-K125 VanDerWaalsContact C-N 3.34Å; M123-K125 PolarHBondContact O-N 3.33Å; M123-M126 PolarHBondContact O-N 3.45Å; M123-K127 WeakPolarHBondContact O-CB 3.43Å; M123-K127 PolarHBondContact O-N 3.06Å
124	D	95.5	Very high	94.7	Very high	42 Å²	42	102 Å²	102	23%	0.225	46%	0.461	C	S	.	.	H	α-helix	trans	-67.1	-36.9	179.2	-68.5	-28.2	0	0	0	111.5	Y37 Q120 K127 R128	Y37-D124 PolarHBondContact OH-OD2 2.99Å; Q120-D124 VanDerWaalsContact NE2-CG 3.32Å; Q120-D124 PolarHBondContact NE2-OD1 3.45Å; Q120-D124 VanDerWaalsContact NE2-OD1 3.09Å; Q120-D124 PolarHBondContact NE2-OD2 2.86Å; Q120-D124 WeakPolarHBondContact O-CB 3.43Å; Q120-D124 PolarHBondContact O-N 3.05Å; D124-K127 PolarHBondContact O-N 2.92Å; D124-R128 WeakPolarHBondContact O-CG 3.32Å; D124-R128 PolarHBondContact O-N 3.02Å
125	K	96.5	Very high	95.3	Very high	115 Å²	115	103.5 Å²	103.5	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-62.1	-43.2	171.1	-175.3	177.2	-178.1	176.7	0	112	Q121 M122 M123 K129	Q121-K125 VanDerWaalsContact O-CB 3.27Å; Q121-K125 WeakPolarHBondContact O-CB 3.47Å; Q121-K125 PolarHBondContact O-N 3.28Å; M122-K125 PolarHBondContact O-N 3.46Å; M123-K125 VanDerWaalsContact C-N 3.34Å; M123-K125 PolarHBondContact O-N 3.33Å; K125-K129 WeakPolarHBondContact O-CG 3.39Å; K125-K129 PolarHBondContact O-N 3.45Å; K125-K129 VanDerWaalsContact O-N 3.09Å
126	M	97.3	Very high	95.6	Very high	129 Å²	129	103.6 Å²	103.6	64%	0.635	47%	0.474	S	S	*	.	H	α-helix	trans	-65.7	-41.2	176.4	-71.2	-60.3	-165.3	0	0	111.7	M122 M123 K129 K130	M122-M126 WeakPolarHBondContact O-CG 3.47Å; M122-M126 PolarHBondContact O-N 3.13Å; M123-M126 PolarHBondContact O-N 3.45Å; M126-K129 PolarHBondContact O-N 2.91Å; M126-K130 WeakPolarHBondContact O-CB 3.46Å; M126-K130 PolarHBondContact O-N 3.23Å
127	K	97.6	Very high	95.9	Very high	125 Å²	125	101.5 Å²	101.5	54%	0.543	47%	0.47	S	S	.	.	H	α-helix	trans	-59.3	-50.2	176	-177.4	179.7	172.3	-175.9	0	111.5	M123 D124 K129 K130 E131	M123-K127 WeakPolarHBondContact O-CB 3.43Å; M123-K127 PolarHBondContact O-N 3.06Å; D124-K127 PolarHBondContact O-N 2.92Å; K127-K129 PolarHBondContact O-N 3.45Å; K127-K130 WeakPolarHBondContact O-CB 3.36Å; K127-K130 PolarHBondContact O-N 2.92Å; K127-K130 VanDerWaalsContact O-N 3.13Å; K127-E131 WeakPolarHBondContact CE-OE1 3.48Å; K127-E131 WeakPolarHBondContact O-CG 3.32Å; K127-E131 PolarHBondContact O-N 3.3Å
128	R	97.4	Very high	96.3	Very high	147 Å²	147	104 Å²	104	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-57.9	-46.5	176	-71.7	-175.8	-54.8	-172.6	3.5	112.2	D124 K130 E131 E132	D124-R128 WeakPolarHBondContact O-CG 3.32Å; D124-R128 PolarHBondContact O-N 3.02Å; R128-K130 VanDerWaalsContact C-N 3.29Å; R128-K130 PolarHBondContact O-N 3.33Å; R128-E131 PolarHBondContact O-N 2.84Å; R128-E132 WeakPolarHBondContact O-CB 3.02Å; R128-E132 WeakPolarHBondContact O-CG 3.45Å; R128-E132 PolarHBondContact O-N 3.13Å
129	K	97.8	Very high	96.6	Very high	122 Å²	122	104.8 Å²	104.8	53%	0.53	49%	0.491	S	S	.	.	H	α-helix	trans	-59.5	-39.7	176.4	-79.3	-171.2	171.1	-165.6	0	112.6	K125 M126 K127 W133	K125-K129 WeakPolarHBondContact O-CG 3.39Å; K125-K129 PolarHBondContact O-N 3.45Å; K125-K129 VanDerWaalsContact O-N 3.09Å; M126-K129 PolarHBondContact O-N 2.91Å; K127-K129 PolarHBondContact O-N 3.45Å; K129-W133 WeakPolarHBondContact O-CB 3.48Å; K129-W133 PolarHBondContact O-N 3.36Å
130	K	98	Very high	96.8	Very high	141 Å²	141	102 Å²	102	61%	0.613	49%	0.489	S	S	*	.	H	α-helix	trans	-64.8	-44.7	176.4	-176.2	-179.9	178.6	-179.1	0	111.1	M126 K127 R128 W133 L134	M126-K130 WeakPolarHBondContact O-CB 3.46Å; M126-K130 PolarHBondContact O-N 3.23Å; K127-K130 WeakPolarHBondContact O-CB 3.36Å; K127-K130 PolarHBondContact O-N 2.92Å; K127-K130 VanDerWaalsContact O-N 3.13Å; R128-K130 VanDerWaalsContact C-N 3.29Å; R128-K130 PolarHBondContact O-N 3.33Å; K130-W133 PolarHBondContact O-N 2.94Å; K130-L134 HydrophobicContact CG-CD1 4.29Å; K130-L134 VanDerWaalsContact O-CG 3.32Å; K130-L134 WeakPolarHBondContact O-CG 3.32Å; K130-L134 PolarHBondContact O-N 2.92Å
131	E	97.9	Very high	97.1	Very high	88 Å²	88	105 Å²	105	41%	0.411	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-46.3	176	-71.4	169	179.2	0	0	111.6	K127 R128 W133 L134 N135	K127-E131 WeakPolarHBondContact CE-OE1 3.48Å; K127-E131 WeakPolarHBondContact O-CG 3.32Å; K127-E131 PolarHBondContact O-N 3.3Å; R128-E131 PolarHBondContact O-N 2.84Å; E131-W133 VanDerWaalsContact C-N 3.3Å; E131-W133 PolarHBondContact O-N 2.96Å; E131-L134 PolarHBondContact O-N 2.92Å; E131-N135 VanDerWaalsContact O-CG 3.27Å; E131-N135 PolarHBondContact O-N 3.38Å
132	E	98	Very high	97.4	Very high	103 Å²	103	106.5 Å²	106.5	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-56.9	-42.5	174	-74	170.1	-160.3	0	0	112.1	R128 K136	R128-E132 WeakPolarHBondContact O-CB 3.02Å; R128-E132 WeakPolarHBondContact O-CG 3.45Å; R128-E132 PolarHBondContact O-N 3.13Å; E132-K136 WeakPolarHBondContact O-CB 3.39Å; E132-K136 WeakPolarHBondContact O-CG 3.34Å; E132-K136 PolarHBondContact O-N 3.35Å
133	W	97.6	Very high	97.5	Very high	170 Å²	170	105.7 Å²	105.7	64%	0.644	51%	0.505	S	S	*	.	H	α-helix	trans	-67.4	-42	177.7	-179	82.4	0	0	0	112.3	K129 K130 E131 K136 S137	K129-W133 WeakPolarHBondContact O-CB 3.48Å; K129-W133 PolarHBondContact O-N 3.36Å; K130-W133 PolarHBondContact O-N 2.94Å; E131-W133 VanDerWaalsContact C-N 3.3Å; E131-W133 PolarHBondContact O-N 2.96Å; W133-K136 PolarHBondContact O-N 2.92Å; W133-S137 WeakPolarHBondContact O-CB 3.48Å; W133-S137 PolarHBondContact O-N 2.98Å
134	L	98	Very high	97.6	Very high	85 Å²	85	105.9 Å²	105.9	45%	0.445	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-43.8	175.8	-73.7	171.1	0	0	0	111.5	K130 E131 S137 A138	K130-L134 HydrophobicContact CG-CD1 4.29Å; K130-L134 VanDerWaalsContact O-CG 3.32Å; K130-L134 WeakPolarHBondContact O-CG 3.32Å; K130-L134 PolarHBondContact O-N 2.92Å; E131-L134 PolarHBondContact O-N 2.92Å; L134-S137 PolarHBondContact O-N 3.43Å; L134-A138 WeakPolarHBondContact O-CB 3.41Å; L134-A138 PolarHBondContact O-N 3.36Å
135	N	97.8	Very high	97.7	Very high	98 Å²	98	107.7 Å²	107.7	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-48.8	177.3	-69.3	-11.6	0	0	0	111.2	E131 S137 A138 E139	E131-N135 VanDerWaalsContact O-CG 3.27Å; E131-N135 PolarHBondContact O-N 3.38Å; N135-S137 VanDerWaalsContact C-N 3.29Å; N135-S137 PolarHBondContact O-N 2.83Å; N135-A138 PolarHBondContact O-N 3.2Å; N135-A138 VanDerWaalsContact O-N 3.13Å; N135-E139 WeakPolarHBondContact O-CG 3.45Å; N135-E139 PolarHBondContact O-N 2.95Å
136	K	97.8	Very high	97.8	Very high	140 Å²	140	105.9 Å²	105.9	61%	0.609	51%	0.51	S	S	*	.	H	α-helix	trans	-59.8	-38.1	176	-74.3	175.6	179.5	178	0	112.8	E132 W133 G140	E132-K136 WeakPolarHBondContact O-CB 3.39Å; E132-K136 WeakPolarHBondContact O-CG 3.34Å; E132-K136 PolarHBondContact O-N 3.35Å; W133-K136 PolarHBondContact O-N 2.92Å; K136-G140 PolarHBondContact O-N 3.09Å
137	S	97.5	Very high	97.8	Very high	44 Å²	44	102.5 Å²	102.5	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-66.7	-40.6	176	-175.7	0	0	0	0	111.8	W133 L134 N135 G140 K141	W133-S137 WeakPolarHBondContact O-CB 3.48Å; W133-S137 PolarHBondContact O-N 2.98Å; L134-S137 PolarHBondContact O-N 3.43Å; N135-S137 VanDerWaalsContact C-N 3.29Å; N135-S137 PolarHBondContact O-N 2.83Å; S137-G140 PolarHBondContact O-N 3.18Å; S137-K141 WeakPolarHBondContact O-CG 3.4Å; S137-K141 PolarHBondContact O-N 2.92Å
138	A	97.9	Very high	97.8	Very high	57 Å²	57	101.8 Å²	101.8	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-45.6	175.9	0	0	0	0	0	111.8	L134 N135 G140 K141 Q142	L134-A138 WeakPolarHBondContact O-CB 3.41Å; L134-A138 PolarHBondContact O-N 3.36Å; N135-A138 PolarHBondContact O-N 3.2Å; N135-A138 VanDerWaalsContact O-N 3.13Å; A138-G140 VanDerWaalsContact C-N 3.34Å; A138-G140 PolarHBondContact O-N 3.09Å; A138-K141 PolarHBondContact O-N 2.49Å; A138-Q142 PolarHBondContact O-N 2.85Å
139	E	97.9	Very high	97.8	Very high	111 Å²	111	100.8 Å²	100.8	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-57.9	-45.1	173.6	-72.4	169.9	-167.1	0	0	111.3	N135 K141 Q142 I143	N135-E139 WeakPolarHBondContact O-CG 3.45Å; N135-E139 PolarHBondContact O-N 2.95Å; E139-K141 PolarHBondContact O-N 2.92Å; E139-Q142 WeakPolarHBondContact O-CB 3.45Å; E139-Q142 PolarHBondContact O-N 3.32Å; E139-I143 WeakPolarHBondContact O-CG1 3.48Å; E139-I143 PolarHBondContact O-N 3.22Å
140	G	97.7	Very high	97.9	Very high	37 Å²	37	101.9 Å²	101.9	38%	0.381	50%	0.498	S	S	.	.	H	α-helix	trans	-59.1	-45.1	176.6	0	0	0	0	0	113	K136 S137 A138 Q142 I143 E144	K136-G140 PolarHBondContact O-N 3.09Å; S137-G140 PolarHBondContact O-N 3.18Å; A138-G140 VanDerWaalsContact C-N 3.34Å; A138-G140 PolarHBondContact O-N 3.09Å; G140-Q142 VanDerWaalsContact C-N 3.33Å; G140-Q142 PolarHBondContact O-N 3.15Å; G140-I143 PolarHBondContact O-N 3.4Å; G140-E144 PolarHBondContact O-N 3.27Å
141	K	97.7	Very high	97.8	Very high	131 Å²	131	101.3 Å²	101.3	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-37.8	175.5	-73.3	178.2	-179.8	-177.9	0	112.4	S137 A138 E139 E144 N145	S137-K141 WeakPolarHBondContact O-CG 3.4Å; S137-K141 PolarHBondContact O-N 2.92Å; A138-K141 PolarHBondContact O-N 2.49Å; E139-K141 PolarHBondContact O-N 2.92Å; K141-E144 PolarHBondContact O-N 3.47Å; K141-N145 VanDerWaalsContact O-CG 3.27Å; K141-N145 PolarHBondContact O-N 3.34Å; K141-N145 PolarHBondContact O-ND2 3.09Å
142	Q	97.8	Very high	97.8	Very high	120 Å²	120	102.1 Å²	102.1	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-47.3	176.4	-177.2	177	-4.2	0	0	110.9	A138 E139 G140 E144 N145 D146	A138-Q142 PolarHBondContact O-N 2.85Å; E139-Q142 WeakPolarHBondContact O-CB 3.45Å; E139-Q142 PolarHBondContact O-N 3.32Å; G140-Q142 VanDerWaalsContact C-N 3.33Å; G140-Q142 PolarHBondContact O-N 3.15Å; Q142-E144 VanDerWaalsContact C-N 3.31Å; Q142-E144 PolarHBondContact O-N 2.92Å; Q142-N145 PolarHBondContact O-N 3.43Å; Q142-D146 PolarHBondContact O-N 3.25Å
143	I	97.6	Very high	97.9	Very high	106 Å²	106	101.3 Å²	101.3	54%	0.544	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-42.1	177.5	-67.5	164.7	0	0	0	110.9	E139 G140 D146 C147	E139-I143 WeakPolarHBondContact O-CG1 3.48Å; E139-I143 PolarHBondContact O-N 3.22Å; G140-I143 PolarHBondContact O-N 3.4Å; I143-D146 PolarHBondContact O-N 2.86Å; I143-C147 WeakPolarHBondContact O-CB 3.48Å; I143-C147 PolarHBondContact O-N 3.5Å; I143-C147 PolarHBondContact O-SG 3.36Å
144	E	97.9	Very high	97.9	Very high	112 Å²	112	97.8 Å²	97.8	52%	0.523	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-48.1	176.3	-173.1	-177.2	175.2	0	0	111.4	G140 K141 Q142 D146 C147 Q148	G140-E144 PolarHBondContact O-N 3.27Å; K141-E144 PolarHBondContact O-N 3.47Å; Q142-E144 VanDerWaalsContact C-N 3.31Å; Q142-E144 PolarHBondContact O-N 2.92Å; E144-D146 VanDerWaalsContact C-N 3.33Å; E144-D146 PolarHBondContact O-N 2.73Å; E144-C147 WeakPolarHBondContact O-CB 3.34Å; E144-C147 PolarHBondContact O-N 3.01Å; E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 3.44Å; E144-Q148 PolarHBondContact OE1-NE2 3.26Å
145	N	97.9	Very high	97.9	Very high	81 Å²	81	97.9 Å²	97.9	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-41.1	177.3	-72.1	-30.2	0	0	0	112.3	K141 Q142 Q148 K149	K141-N145 VanDerWaalsContact O-CG 3.27Å; K141-N145 PolarHBondContact O-N 3.34Å; K141-N145 PolarHBondContact O-ND2 3.09Å; Q142-N145 PolarHBondContact O-N 3.43Å; N145-Q148 PolarHBondContact O-N 3.37Å; N145-K149 WeakPolarHBondContact O-CG 3.27Å; N145-K149 PolarHBondContact O-N 2.99Å
146	D	98.1	Very high	97.9	Very high	77 Å²	77	95.4 Å²	95.4	41%	0.412	47%	0.473	S	S	.	.	H	α-helix	trans	-68.8	-38.5	179.1	-69.7	-18.4	0	0	0	111.4	Q142 I143 E144 K149 Y150	Q142-D146 PolarHBondContact O-N 3.25Å; I143-D146 PolarHBondContact O-N 2.86Å; E144-D146 VanDerWaalsContact C-N 3.33Å; E144-D146 PolarHBondContact O-N 2.73Å; D146-K149 PolarHBondContact O-N 2.89Å; D146-K149 IonicContact OD1-NZ 3.34Å; D146-Y150 WeakPolarHBondContact O-CB 3.38Å; D146-Y150 PolarHBondContact O-N 3.16Å
147	C	97.9	Very high	97.9	Very high	57 Å²	57	93.3 Å²	93.3	39%	0.385	47%	0.469	S	S	.	.	H	α-helix	trans	-60.3	-48.2	171.3	-69.5	0	0	0	0	111.4	I143 E144 K149 Y150 F151	I143-C147 WeakPolarHBondContact O-CB 3.48Å; I143-C147 PolarHBondContact O-N 3.5Å; I143-C147 PolarHBondContact O-SG 3.36Å; E144-C147 WeakPolarHBondContact O-CB 3.34Å; E144-C147 PolarHBondContact O-N 3.01Å; C147-K149 PolarHBondContact O-N 3.24Å; C147-Y150 WeakPolarHBondContact O-CB 3.48Å; C147-Y150 PolarHBondContact O-N 3.44Å; C147-F151 HydrophobicContact CB-CE2 4.31Å; C147-F151 WeakPolarHBondContact O-CD2 3.31Å; C147-F151 PolarHBondContact O-N 3.19Å
148	Q	97.8	Very high	97.9	Very high	111 Å²	111	96.6 Å²	96.6	52%	0.519	48%	0.479	S	S	.	.	H	α-helix	trans	-59	-46.2	178.4	-72.5	179.2	12.5	0	0	111.6	E144 N145 Y150 F151 H152	E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 3.44Å; E144-Q148 PolarHBondContact OE1-NE2 3.26Å; N145-Q148 PolarHBondContact O-N 3.37Å; Q148-Y150 VanDerWaalsContact C-N 3.35Å; Q148-Y150 PolarHBondContact O-N 3.31Å; Q148-F151 PolarHBondContact O-N 3.36Å; Q148-H152 WeakPolarHBondContact O-CB 3.4Å; Q148-H152 PolarHBondContact O-N 3.14Å
149	K	98	Very high	97.9	Very high	126 Å²	126	99.2 Å²	99.2	55%	0.548	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-43.3	175.2	-73.1	172.1	-173.6	168.2	0	111.9	N145 D146 C147 H152 N153	N145-K149 WeakPolarHBondContact O-CG 3.27Å; N145-K149 PolarHBondContact O-N 2.99Å; D146-K149 PolarHBondContact O-N 2.89Å; D146-K149 IonicContact OD1-NZ 3.34Å; C147-K149 PolarHBondContact O-N 3.24Å; K149-H152 PolarHBondContact O-N 3.13Å; K149-N153 WeakPolarHBondContact O-CB 3.48Å; K149-N153 VanDerWaalsContact O-CG 3.23Å; K149-N153 PolarHBondContact O-N 2.94Å; K149-N153 PolarHBondContact O-ND2 3.46Å
150	Y	98.3	Very high	97.9	Very high	144 Å²	144	100.5 Å²	100.5	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-60.4	-49	177.9	173.7	-97.7	0	0	0	111.6	D146 C147 Q148 H152 N153 K154	D146-Y150 WeakPolarHBondContact O-CB 3.38Å; D146-Y150 PolarHBondContact O-N 3.16Å; C147-Y150 WeakPolarHBondContact O-CB 3.48Å; C147-Y150 PolarHBondContact O-N 3.44Å; Q148-Y150 VanDerWaalsContact C-N 3.35Å; Q148-Y150 PolarHBondContact O-N 3.31Å; Y150-H152 PolarHBondContact O-N 3.12Å; Y150-N153 PolarHBondContact O-N 3.2Å; Y150-K154 HydrophobicContact CE1-CD 4.36Å; Y150-K154 VanDerWaalsContact O-CB 3.3Å; Y150-K154 WeakPolarHBondContact O-CB 3.2Å; Y150-K154 PolarHBondContact O-N 3.44Å
151	F	97.9	Very high	97.9	Very high	129 Å²	129	105.6 Å²	105.6	57%	0.566	50%	0.498	S	S	*	.	H	α-helix	trans	-63	-42.2	178.2	-72.9	-61.3	0	0	0	112.2	C147 Q148 K154 M155	C147-F151 HydrophobicContact CB-CE2 4.31Å; C147-F151 WeakPolarHBondContact O-CD2 3.31Å; C147-F151 PolarHBondContact O-N 3.19Å; Q148-F151 PolarHBondContact O-N 3.36Å; F151-K154 PolarHBondContact O-N 2.91Å; F151-M155 WeakPolarHBondContact O-CB 3.42Å; F151-M155 PolarHBondContact O-N 3.2Å
152	H	97.9	Very high	97.9	Very high	106 Å²	106	108 Å²	108	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-48.9	175.8	-177.7	72.7	0	0	0	111.8	Q148 K149 Y150 K154 M155 I156	Q148-H152 WeakPolarHBondContact O-CB 3.4Å; Q148-H152 PolarHBondContact O-N 3.14Å; K149-H152 PolarHBondContact O-N 3.13Å; Y150-H152 PolarHBondContact O-N 3.12Å; H152-K154 PolarHBondContact O-N 3.45Å; H152-M155 PolarHBondContact O-N 3.24Å; H152-I156 WeakPolarHBondContact NE2-CD1 3.39Å; H152-I156 WeakPolarHBondContact O-CG1 3.46Å; H152-I156 PolarHBondContact O-N 2.94Å
153	N	98.3	Very high	97.8	Very high	86 Å²	86	104.9 Å²	104.9	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-40	178.1	-73.4	-22.7	0	0	0	112.1	K149 Y150 I156 N157	K149-N153 WeakPolarHBondContact O-CB 3.48Å; K149-N153 VanDerWaalsContact O-CG 3.23Å; K149-N153 PolarHBondContact O-N 2.94Å; K149-N153 PolarHBondContact O-ND2 3.46Å; Y150-N153 PolarHBondContact O-N 3.2Å; N153-I156 PolarHBondContact O-N 2.89Å; N153-N157 VanDerWaalsContact O-CB 3.32Å; N153-N157 WeakPolarHBondContact O-CB 3.44Å; N153-N157 PolarHBondContact O-N 3.35Å; N153-N157 PolarHBondContact O-ND2 3.31Å
154	K	98.2	Very high	97.8	Very high	95 Å²	95	105.7 Å²	105.7	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.2	-176.9	-179.2	175.3	-173.9	0	110.8	Y150 F151 H152 I156 N157 E158	Y150-K154 HydrophobicContact CE1-CD 4.36Å; Y150-K154 VanDerWaalsContact O-CB 3.3Å; Y150-K154 WeakPolarHBondContact O-CB 3.2Å; Y150-K154 PolarHBondContact O-N 3.44Å; F151-K154 PolarHBondContact O-N 2.91Å; H152-K154 PolarHBondContact O-N 3.45Å; K154-I156 PolarHBondContact O-N 2.93Å; K154-N157 PolarHBondContact O-N 3.46Å; K154-E158 WeakPolarHBondContact CE-OE1 3.18Å; K154-E158 WeakPolarHBondContact O-CG 3.42Å; K154-E158 PolarHBondContact O-N 2.76Å
155	M	97.8	Very high	97.7	Very high	87 Å²	87	105.1 Å²	105.1	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-46.1	177.6	-173.6	-153.3	68	0	0	111.7	F151 H152 N157 E158 Q159	F151-M155 WeakPolarHBondContact O-CB 3.42Å; F151-M155 PolarHBondContact O-N 3.2Å; H152-M155 PolarHBondContact O-N 3.24Å; M155-N157 VanDerWaalsContact C-N 3.33Å; M155-N157 PolarHBondContact O-N 3.08Å; M155-E158 PolarHBondContact O-N 3.19Å; M155-Q159 WeakPolarHBondContact O-CG 3.34Å; M155-Q159 PolarHBondContact O-N 3.47Å
156	I	98.1	Very high	97.7	Very high	46 Å²	46	104.2 Å²	104.2	24%	0.236	49%	0.492	C	S	.	.	H	α-helix	trans	-60.2	-43.9	176.3	-72	175.4	0	0	0	111	H152 N153 K154 Q159 K160	H152-I156 WeakPolarHBondContact NE2-CD1 3.39Å; H152-I156 WeakPolarHBondContact O-CG1 3.46Å; H152-I156 PolarHBondContact O-N 2.94Å; N153-I156 PolarHBondContact O-N 2.89Å; K154-I156 PolarHBondContact O-N 2.93Å; I156-Q159 PolarHBondContact O-N 3.03Å; I156-K160 HydrophobicContact CG2-CD 4.02Å; I156-K160 HydrophobicContact CG2-CG 4.37Å; I156-K160 WeakPolarHBondContact O-CG 3.21Å; I156-K160 PolarHBondContact O-N 3.46Å
157	N	97.8	Very high	97.7	Very high	97 Å²	97	103.6 Å²	103.6	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-66.4	-38.5	-179.5	-73.7	-18	0	0	0	111.9	N153 K154 M155 K160 K161	N153-N157 VanDerWaalsContact O-CB 3.32Å; N153-N157 WeakPolarHBondContact O-CB 3.44Å; N153-N157 PolarHBondContact O-N 3.35Å; N153-N157 PolarHBondContact O-ND2 3.31Å; K154-N157 PolarHBondContact O-N 3.46Å; M155-N157 VanDerWaalsContact C-N 3.33Å; M155-N157 PolarHBondContact O-N 3.08Å; N157-K160 PolarHBondContact O-N 3.12Å; N157-K161 VanDerWaalsContact O-CB 3.26Å; N157-K161 WeakPolarHBondContact O-CB 3.12Å; N157-K161 PolarHBondContact O-N 3Å
158	E	97.6	Very high	97.6	Very high	112 Å²	112	105.3 Å²	105.3	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-63.1	-42.6	173.2	-75.1	176.1	-177.6	0	0	111.7	K154 M155 K161 R162	K154-E158 WeakPolarHBondContact CE-OE1 3.18Å; K154-E158 WeakPolarHBondContact O-CG 3.42Å; K154-E158 PolarHBondContact O-N 2.76Å; M155-E158 PolarHBondContact O-N 3.19Å; E158-K161 PolarHBondContact O-N 3.35Å; E158-R162 WeakPolarHBondContact O-CB 3.46Å; E158-R162 PolarHBondContact O-N 3.17Å
159	Q	97.3	Very high	97.5	Very high	113 Å²	113	107.1 Å²	107.1	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-46.1	175	-71.4	177.1	8.6	0	0	112	M155 I156 K161 R162 A163	M155-Q159 WeakPolarHBondContact O-CG 3.34Å; M155-Q159 PolarHBondContact O-N 3.47Å; I156-Q159 PolarHBondContact O-N 3.03Å; Q159-K161 PolarHBondContact O-N 2.6Å; Q159-R162 PolarHBondContact O-N 2.65Å; Q159-A163 WeakPolarHBondContact O-CB 3.16Å; Q159-A163 PolarHBondContact O-N 2.64Å
160	K	97.7	Very high	97.5	Very high	138 Å²	138	104.3 Å²	104.3	60%	0.6	49%	0.486	S	S	*	.	H	α-helix	trans	-60.3	-44.7	175.8	-74.9	178	178.7	177.6	0	111.6	I156 N157 A163 F164	I156-K160 HydrophobicContact CG2-CD 4.02Å; I156-K160 HydrophobicContact CG2-CG 4.37Å; I156-K160 WeakPolarHBondContact O-CG 3.21Å; I156-K160 PolarHBondContact O-N 3.46Å; N157-K160 PolarHBondContact O-N 3.12Å; K160-A163 PolarHBondContact O-N 3.01Å; K160-F164 WeakPolarHBondContact O-CB 3.46Å; K160-F164 PolarHBondContact O-N 3.02Å
161	K	97.8	Very high	97.5	Very high	144 Å²	144	101.9 Å²	101.9	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-61.1	-44.9	176.1	-177.4	178.7	179.4	-179.9	0	111.2	N157 E158 Q159 F164 L165	N157-K161 VanDerWaalsContact O-CB 3.26Å; N157-K161 WeakPolarHBondContact O-CB 3.12Å; N157-K161 PolarHBondContact O-N 3Å; E158-K161 PolarHBondContact O-N 3.35Å; Q159-K161 PolarHBondContact O-N 2.6Å; K161-F164 PolarHBondContact O-N 2.77Å; K161-L165 HydrophobicContact CG-CD1 4.2Å; K161-L165 VanDerWaalsContact O-CG 3.31Å; K161-L165 WeakPolarHBondContact O-CG 3.46Å; K161-L165 PolarHBondContact O-N 3.03Å
162	R	97.4	Very high	97.5	Very high	182 Å²	182	100.4 Å²	100.4	69%	0.687	48%	0.479	S	S	*	.	H	α-helix	trans	-62.3	-47.4	176.8	-177.5	179	177.1	-178.9	-0.7	111.5	E158 Q159 F164 L165 L166	E158-R162 WeakPolarHBondContact O-CB 3.46Å; E158-R162 PolarHBondContact O-N 3.17Å; Q159-R162 PolarHBondContact O-N 2.65Å; R162-F164 VanDerWaalsContact C-N 3.33Å; R162-F164 PolarHBondContact O-N 2.5Å; R162-L165 PolarHBondContact O-N 3.21Å; R162-L166 HydrophobicContact CG-CD1 4.26Å; R162-L166 WeakPolarHBondContact O-CG 3.1Å; R162-L166 PolarHBondContact O-N 3.48Å
163	A	97	Very high	97.5	Very high	54 Å²	54	100.6 Å²	100.6	45%	0.446	48%	0.478	S	S	.	.	H	α-helix	trans	-58.8	-46.2	177.4	0	0	0	0	0	111.1	Q159 K160 L165 L166 T167	Q159-A163 WeakPolarHBondContact O-CB 3.16Å; Q159-A163 PolarHBondContact O-N 2.64Å; K160-A163 PolarHBondContact O-N 3.01Å; A163-L165 PolarHBondContact O-N 3.43Å; A163-L166 PolarHBondContact O-N 3.41Å; A163-T167 WeakPolarHBondContact O-CG2 3.44Å; A163-T167 PolarHBondContact O-N 2.95Å
164	F	96.3	Very high	97.4	Very high	122 Å²	122	103.5 Å²	103.5	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-57.1	-50.2	174.4	179.4	-93.7	0	0	0	111.8	K160 K161 R162 L166 T167 F168	K160-F164 WeakPolarHBondContact O-CB 3.46Å; K160-F164 PolarHBondContact O-N 3.02Å; K161-F164 PolarHBondContact O-N 2.77Å; R162-F164 VanDerWaalsContact C-N 3.33Å; R162-F164 PolarHBondContact O-N 2.5Å; F164-L166 VanDerWaalsContact C-N 3.27Å; F164-L166 PolarHBondContact O-N 2.94Å; F164-T167 PolarHBondContact O-N 3.22Å; F164-T167 VanDerWaalsContact O-N 3.14Å; F164-T167 PolarHBondContact O-OG1 3.36Å; F164-F168 HydrophobicContact CD1-CD2 4.05Å; F164-F168 HydrophobicContact CD1-CE2 4.01Å; F164-F168 HydrophobicContact CD2-CD2 4.48Å; F164-F168 AromaticContact CD2-CE2 3.88Å; F164-F168 HydrophobicContact CD2-CE2 3.88Å; F164-F168 AromaticContact CE1-CD2 3.79Å; F164-F168 HydrophobicContact CE1-CD2 3.79Å; F164-F168 AromaticContact CE1-CE2 3.47Å; F164-F168 HydrophobicContact CE1-CE2 3.47Å; F164-F168 VanDerWaalsContact CE1-CE2 3.47Å; F164-F168 HydrophobicContact CE1-CZ 4.27Å; F164-F168 HydrophobicContact CE2-CD2 4.28Å; F164-F168 AromaticContact CE2-CE2 3.35Å; F164-F168 HydrophobicContact CE2-CE2 3.35Å; F164-F168 HydrophobicContact CE2-CZ 4.06Å; F164-F168 HydrophobicContact CG-CD2 4.39Å; F164-F168 HydrophobicContact CG-CE2 4.2Å; F164-F168 AromaticContact CZ-CD2 3.93Å; F164-F168 HydrophobicContact CZ-CD2 3.93Å; F164-F168 AromaticContact CZ-CE2 3.11Å; F164-F168 HydrophobicContact CZ-CE2 3.11Å; F164-F168 AromaticContact CZ-CZ 3.68Å; F164-F168 HydrophobicContact CZ-CZ 3.68Å; F164-F168 WeakPolarHBondContact O-CD2 3.28Å; F164-F168 PolarHBondContact O-N 2.95Å
165	L	97.5	Very high	97.4	Very high	100 Å²	100	103.5 Å²	103.5	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-33	180	-69	172.9	0	0	0	113.2	K161 R162 A163 R169	K161-L165 HydrophobicContact CG-CD1 4.2Å; K161-L165 VanDerWaalsContact O-CG 3.31Å; K161-L165 WeakPolarHBondContact O-CG 3.46Å; K161-L165 PolarHBondContact O-N 3.03Å; R162-L165 PolarHBondContact O-N 3.21Å; A163-L165 PolarHBondContact O-N 3.43Å; L165-R169 WeakPolarHBondContact O-CB 3.44Å; L165-R169 PolarHBondContact O-N 3.41Å
166	L	97.5	Very high	97.4	Very high	63 Å²	63	104.9 Å²	104.9	33%	0.33	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-38.9	175.1	-71.3	170.9	0	0	0	112.1	R162 A163 F164 F168 R169 D170	R162-L166 HydrophobicContact CG-CD1 4.26Å; R162-L166 WeakPolarHBondContact O-CG 3.1Å; R162-L166 PolarHBondContact O-N 3.48Å; A163-L166 PolarHBondContact O-N 3.41Å; F164-L166 VanDerWaalsContact C-N 3.27Å; F164-L166 PolarHBondContact O-N 2.94Å; L166-F168 PolarHBondContact O-N 2.94Å; L166-R169 WeakPolarHBondContact O-CB 3.38Å; L166-R169 PolarHBondContact O-N 3.38Å; L166-D170 PolarHBondContact O-N 2.89Å
167	T	97.1	Very high	97.4	Very high	64 Å²	64	106.9 Å²	106.9	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-42	178	66.5	0	0	0	0	111.8	A163 F164 D170 M171	A163-T167 WeakPolarHBondContact O-CG2 3.44Å; A163-T167 PolarHBondContact O-N 2.95Å; F164-T167 PolarHBondContact O-N 3.22Å; F164-T167 VanDerWaalsContact O-N 3.14Å; F164-T167 PolarHBondContact O-OG1 3.36Å; T167-D170 PolarHBondContact O-N 2.8Å; T167-M171 WeakPolarHBondContact O-CB 3.43Å; T167-M171 WeakPolarHBondContact O-CE 3.33Å; T167-M171 WeakPolarHBondContact O-CG 3.4Å; T167-M171 PolarHBondContact O-N 2.74Å
168	F	95.4	Very high	97.4	Very high	92 Å²	92	106.1 Å²	106.1	40%	0.404	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.3	-79	-88.6	0	0	0	112.3	F164 L166 D170 M171 N172	F164-F168 HydrophobicContact CD1-CD2 4.05Å; F164-F168 HydrophobicContact CD1-CE2 4.01Å; F164-F168 HydrophobicContact CD2-CD2 4.48Å; F164-F168 AromaticContact CD2-CE2 3.88Å; F164-F168 HydrophobicContact CD2-CE2 3.88Å; F164-F168 AromaticContact CE1-CD2 3.79Å; F164-F168 HydrophobicContact CE1-CD2 3.79Å; F164-F168 AromaticContact CE1-CE2 3.47Å; F164-F168 HydrophobicContact CE1-CE2 3.47Å; F164-F168 VanDerWaalsContact CE1-CE2 3.47Å; F164-F168 HydrophobicContact CE1-CZ 4.27Å; F164-F168 HydrophobicContact CE2-CD2 4.28Å; F164-F168 AromaticContact CE2-CE2 3.35Å; F164-F168 HydrophobicContact CE2-CE2 3.35Å; F164-F168 HydrophobicContact CE2-CZ 4.06Å; F164-F168 HydrophobicContact CG-CD2 4.39Å; F164-F168 HydrophobicContact CG-CE2 4.2Å; F164-F168 AromaticContact CZ-CD2 3.93Å; F164-F168 HydrophobicContact CZ-CD2 3.93Å; F164-F168 AromaticContact CZ-CE2 3.11Å; F164-F168 HydrophobicContact CZ-CE2 3.11Å; F164-F168 AromaticContact CZ-CZ 3.68Å; F164-F168 HydrophobicContact CZ-CZ 3.68Å; F164-F168 WeakPolarHBondContact O-CD2 3.28Å; F164-F168 PolarHBondContact O-N 2.95Å; L166-F168 PolarHBondContact O-N 2.94Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.16Å; F168-M171 PolarHBondContact O-N 2.98Å; F168-N172 WeakPolarHBondContact O-CB 3.17Å; F168-N172 PolarHBondContact O-N 2.88Å; F168-N172 PolarHBondContact O-ND2 2.9Å
169	R	97.4	Very high	97.4	Very high	149 Å²	149	104.2 Å²	104.2	56%	0.562	49%	0.492	S	S	*	.	H	α-helix	trans	-56.9	-47.1	174.4	-176.2	-160	69.2	179.1	-0.4	110.9	L165 L166 N172 K173	L165-R169 WeakPolarHBondContact O-CB 3.44Å; L165-R169 PolarHBondContact O-N 3.41Å; L166-R169 WeakPolarHBondContact O-CB 3.38Å; L166-R169 PolarHBondContact O-N 3.38Å; R169-N172 PolarHBondContact O-N 3.47Å; R169-K173 WeakPolarHBondContact O-CB 3.3Å; R169-K173 PolarHBondContact O-N 3.48Å
170	D	97.8	Very high	97.3	Very high	68 Å²	68	103.5 Å²	103.5	36%	0.364	49%	0.489	S	S	.	.	H	α-helix	trans	-70.9	-36.6	-176.9	-64.5	-10.3	0	0	0	111.8	L166 T167 F168 K173 K174	L166-D170 PolarHBondContact O-N 2.89Å; T167-D170 PolarHBondContact O-N 2.8Å; F168-D170 VanDerWaalsContact C-N 3.3Å; F168-D170 PolarHBondContact O-N 3.16Å; D170-K173 PolarHBondContact O-N 3.09Å; D170-K174 WeakPolarHBondContact O-CG 3Å; D170-K174 PolarHBondContact O-N 3.01Å
171	M	97.6	Very high	97.3	Very high	93 Å²	93	103.3 Å²	103.3	46%	0.458	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-45.2	171.9	-75.5	-175.3	-94.9	0	0	112	T167 F168 K173 K174 I175	T167-M171 WeakPolarHBondContact O-CB 3.43Å; T167-M171 WeakPolarHBondContact O-CE 3.33Å; T167-M171 WeakPolarHBondContact O-CG 3.4Å; T167-M171 PolarHBondContact O-N 2.74Å; F168-M171 PolarHBondContact O-N 2.98Å; M171-K173 VanDerWaalsContact C-N 3.28Å; M171-K173 PolarHBondContact O-N 3.49Å; M171-K174 PolarHBondContact O-N 3.04Å; M171-I175 WeakPolarHBondContact O-CG1 3.47Å; M171-I175 PolarHBondContact O-N 2.94Å
172	N	97.1	Very high	97.3	Very high	98 Å²	98	99.3 Å²	99.3	52%	0.524	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-38.2	176.3	-71.1	-10.7	0	0	0	111.5	F168 R169 I175 M176	F168-N172 WeakPolarHBondContact O-CB 3.17Å; F168-N172 PolarHBondContact O-N 2.88Å; F168-N172 PolarHBondContact O-ND2 2.9Å; R169-N172 PolarHBondContact O-N 3.47Å; N172-I175 PolarHBondContact O-N 3.31Å; N172-M176 WeakPolarHBondContact O-CB 3.05Å; N172-M176 PolarHBondContact O-N 3.46Å
173	K	98.1	Very high	97.2	Very high	110 Å²	110	99 Å²	99	48%	0.478	47%	0.468	S	S	.	.	H	α-helix	trans	-61.1	-46.8	174.2	-165.3	-172.8	-174	-110.9	0	111.5	R169 D170 M171 I175 M176 E177	R169-K173 WeakPolarHBondContact O-CB 3.3Å; R169-K173 PolarHBondContact O-N 3.48Å; D170-K173 PolarHBondContact O-N 3.09Å; M171-K173 VanDerWaalsContact C-N 3.28Å; M171-K173 PolarHBondContact O-N 3.49Å; K173-I175 PolarHBondContact O-N 3.39Å; K173-M176 HydrophobicContact CG-CE 4.25Å; K173-M176 PolarHBondContact O-N 2.94Å; K173-E177 VanDerWaalsContact CE-OE1 3.23Å; K173-E177 WeakPolarHBondContact CE-OE1 3.49Å; K173-E177 IonicContact NZ-OE1 2.76Å; K173-E177 PolarHBondContact NZ-OE1 2.94Å; K173-E177 WeakPolarHBondContact O-CG 3.32Å; K173-E177 PolarHBondContact O-N 3.02Å
174	K	97.8	Very high	97.2	Very high	146 Å²	146	102.6 Å²	102.6	64%	0.635	47%	0.473	S	S	*	.	H	α-helix	trans	-60	-42.9	177	-73.1	178.7	179.8	-176.4	0	112.5	D170 M171 M176 E177 E178	D170-K174 WeakPolarHBondContact O-CG 3Å; D170-K174 PolarHBondContact O-N 3.01Å; M171-K174 PolarHBondContact O-N 3.04Å; K174-M176 VanDerWaalsContact C-N 3.35Å; K174-E177 PolarHBondContact O-N 3.33Å; K174-E178 WeakPolarHBondContact O-CB 3.42Å; K174-E178 PolarHBondContact O-N 3.05Å
175	I	97.4	Very high	97.2	Very high	96 Å²	96	99.8 Å²	99.8	49%	0.492	47%	0.466	S	S	.	.	H	α-helix	trans	-63.2	-43.3	177.3	-67.5	167	0	0	0	110.7	M171 N172 K173 E178 N179	M171-I175 WeakPolarHBondContact O-CG1 3.47Å; M171-I175 PolarHBondContact O-N 2.94Å; N172-I175 PolarHBondContact O-N 3.31Å; K173-I175 PolarHBondContact O-N 3.39Å; I175-E178 PolarHBondContact O-N 2.84Å; I175-N179 WeakPolarHBondContact O-CB 2.96Å; I175-N179 PolarHBondContact O-N 3.49Å; I175-N179 PolarHBondContact O-ND2 3.3Å
176	M	97.4	Very high	97.1	Very high	116 Å²	116	99.7 Å²	99.7	57%	0.571	46%	0.463	S	S	*	.	H	α-helix	trans	-62.6	-45.4	177.6	179	179.7	58.4	0	0	112	N172 K173 K174 N179 E180	N172-M176 WeakPolarHBondContact O-CB 3.05Å; N172-M176 PolarHBondContact O-N 3.46Å; K173-M176 HydrophobicContact CG-CE 4.25Å; K173-M176 PolarHBondContact O-N 2.94Å; K174-M176 VanDerWaalsContact C-N 3.35Å; M176-N179 PolarHBondContact O-N 2.92Å; M176-E180 PolarHBondContact O-N 3.37Å
177	E	97.7	Very high	96.8	Very high	88 Å²	88	103.7 Å²	103.7	41%	0.411	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-41.9	176.9	-72	170.7	177.2	0	0	111.7	K173 K174 E180 R181	K173-E177 VanDerWaalsContact CE-OE1 3.23Å; K173-E177 WeakPolarHBondContact CE-OE1 3.49Å; K173-E177 IonicContact NZ-OE1 2.76Å; K173-E177 PolarHBondContact NZ-OE1 2.94Å; K173-E177 WeakPolarHBondContact O-CG 3.32Å; K173-E177 PolarHBondContact O-N 3.02Å; K174-E177 PolarHBondContact O-N 3.33Å; E177-E180 PolarHBondContact O-N 3.29Å; E177-R181 PolarHBondContact O-N 3.34Å
178	E	97.7	Very high	96.6	Very high	80 Å²	80	109.5 Å²	109.5	37%	0.374	49%	0.488	S	S	.	.	H	α-helix	trans	-66.7	-42.6	176.5	-179.2	57.5	-163.9	0	0	111.7	K174 I175 E180 R181 I182	K174-E178 WeakPolarHBondContact O-CB 3.42Å; K174-E178 PolarHBondContact O-N 3.05Å; I175-E178 PolarHBondContact O-N 2.84Å; E178-E180 VanDerWaalsContact C-N 3.29Å; E178-E180 PolarHBondContact O-N 2.98Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 3.41Å; E178-R181 VanDerWaalsContact O-N 3.15Å; E178-R181 IonicContact OE1-CZ 3.95Å; E178-R181 IonicContact OE1-NE 2.68Å; E178-R181 PolarHBondContact OE1-NE 3.25Å; E178-R181 IonicContact OE1-NH2 3.98Å; E178-R181 PolarHBondContact OE1-NH2 2.92Å; E178-R181 IonicContact OE2-CZ 3.7Å; E178-R181 IonicContact OE2-NE 3.98Å; E178-R181 PolarHBondContact OE2-NE 3.36Å; E178-R181 IonicContact OE2-NH2 2.69Å; E178-I182 HydrophobicContact CG-CD1 4.07Å; E178-I182 WeakPolarHBondContact O-CG1 3.46Å; E178-I182 PolarHBondContact O-N 2.93Å
179	N	97.6	Very high	96.5	Very high	73 Å²	73	109.1 Å²	109.1	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-61.5	-38.2	174.4	-74.3	-19.3	0	0	0	111.8	I175 M176 I182 R183	I175-N179 WeakPolarHBondContact O-CB 2.96Å; I175-N179 PolarHBondContact O-N 3.49Å; I175-N179 PolarHBondContact O-ND2 3.3Å; M176-N179 PolarHBondContact O-N 2.92Å; N179-I182 PolarHBondContact O-N 3.44Å; N179-R183 WeakPolarHBondContact O-CB 2.89Å; N179-R183 VanDerWaalsContact O-CG 3.28Å; N179-R183 WeakPolarHBondContact O-CG 3.21Å; N179-R183 PolarHBondContact O-N 3.1Å
180	E	97	Very high	96.1	Very high	98 Å²	98	106.1 Å²	106.1	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.7	-166.9	-171.5	157.4	0	0	111.5	M176 E177 E178 R183 K184	M176-E180 PolarHBondContact O-N 3.37Å; E177-E180 PolarHBondContact O-N 3.29Å; E178-E180 VanDerWaalsContact C-N 3.29Å; E178-E180 PolarHBondContact O-N 2.98Å; E180-R183 PolarHBondContact O-N 2.83Å; E180-K184 WeakPolarHBondContact O-CG 3.5Å; E180-K184 PolarHBondContact O-N 3.41Å; E180-K184 WeakPolarHBondContact OE1-CE 3.26Å; E180-K184 IonicContact OE1-NZ 3.73Å; E180-K184 PolarHBondContact OE1-NZ 2.96Å
181	R	97.3	Very high	95.8	Very high	134 Å²	134	105 Å²	105	51%	0.506	48%	0.477	S	S	.	.	H	α-helix	trans	-61.7	-46	174.9	-168.1	-171.3	72.8	79.6	2.7	111.3	E177 E178 K184 V185	E177-R181 PolarHBondContact O-N 3.34Å; E178-R181 WeakPolarHBondContact O-CB 3.3Å; E178-R181 PolarHBondContact O-N 3.41Å; E178-R181 VanDerWaalsContact O-N 3.15Å; E178-R181 IonicContact OE1-CZ 3.95Å; E178-R181 IonicContact OE1-NE 2.68Å; E178-R181 PolarHBondContact OE1-NE 3.25Å; E178-R181 IonicContact OE1-NH2 3.98Å; E178-R181 PolarHBondContact OE1-NH2 2.92Å; E178-R181 IonicContact OE2-CZ 3.7Å; E178-R181 IonicContact OE2-NE 3.98Å; E178-R181 PolarHBondContact OE2-NE 3.36Å; E178-R181 IonicContact OE2-NH2 2.69Å; R181-K184 PolarHBondContact O-N 3.16Å; R181-V185 WeakPolarHBondContact O-CG2 3.47Å; R181-V185 PolarHBondContact O-N 3.45Å; R181-V185 VanDerWaalsContact O-N 3.1Å
182	I	97.5	Very high	95.4	Very high	60 Å²	60	105 Å²	105	31%	0.308	48%	0.475	S	S	.	.	H	α-helix	trans	-59.4	-51.6	176.7	-68.5	166.4	0	0	0	109.9	E178 N179 K184 V185 E186	E178-I182 HydrophobicContact CG-CD1 4.07Å; E178-I182 WeakPolarHBondContact O-CG1 3.46Å; E178-I182 PolarHBondContact O-N 2.93Å; N179-I182 PolarHBondContact O-N 3.44Å; I182-K184 VanDerWaalsContact C-N 3.28Å; I182-K184 PolarHBondContact O-N 3.32Å; I182-V185 WeakPolarHBondContact O-CA 3.48Å; I182-V185 WeakPolarHBondContact O-CB 3.44Å; I182-V185 PolarHBondContact O-N 2.8Å; I182-E186 HydrophobicContact CG2-CG 4.15Å; I182-E186 WeakPolarHBondContact CG2-OE1 3.48Å; I182-E186 WeakPolarHBondContact O-CG 3.46Å; I182-E186 PolarHBondContact O-N 3.19Å
183	R	96.1	Very high	95	Very high	175 Å²	175	105 Å²	105	66%	0.66	47%	0.472	S	S	*	.	H	α-helix	trans	-57.6	-37.6	177.9	-73.7	175.7	-172.1	174.4	2.6	113.3	N179 E180 R187	N179-R183 WeakPolarHBondContact O-CB 2.89Å; N179-R183 VanDerWaalsContact O-CG 3.28Å; N179-R183 WeakPolarHBondContact O-CG 3.21Å; N179-R183 PolarHBondContact O-N 3.1Å; E180-R183 PolarHBondContact O-N 2.83Å; R183-R187 VanDerWaalsContact O-CB 3.25Å; R183-R187 WeakPolarHBondContact O-CB 3.27Å; R183-R187 PolarHBondContact O-N 3.11Å
184	K	95.7	Very high	94.5	Very high	130 Å²	130	100 Å²	100	57%	0.565	45%	0.45	S	S	*	.	H	α-helix	trans	-66.5	-36.9	175.8	-76.5	173.9	-176.1	166.5	0	112.2	E180 R181 I182 R188	E180-K184 WeakPolarHBondContact O-CG 3.5Å; E180-K184 PolarHBondContact O-N 3.41Å; E180-K184 WeakPolarHBondContact OE1-CE 3.26Å; E180-K184 IonicContact OE1-NZ 3.73Å; E180-K184 PolarHBondContact OE1-NZ 2.96Å; R181-K184 PolarHBondContact O-N 3.16Å; I182-K184 VanDerWaalsContact C-N 3.28Å; I182-K184 PolarHBondContact O-N 3.32Å; K184-R188 PolarHBondContact O-N 3.29Å; K184-R188 VanDerWaalsContact O-N 3.16Å
185	V	96.7	Very high	94.1	Very high	62 Å²	62	99.6 Å²	99.6	38%	0.376	45%	0.445	S	S	.	.	H	α-helix	trans	-72	-46.8	176.1	172.9	0	0	0	0	110.6	R181 I182 R187 R188 N189	R181-V185 WeakPolarHBondContact O-CG2 3.47Å; R181-V185 PolarHBondContact O-N 3.45Å; R181-V185 VanDerWaalsContact O-N 3.1Å; I182-V185 WeakPolarHBondContact O-CA 3.48Å; I182-V185 WeakPolarHBondContact O-CB 3.44Å; I182-V185 PolarHBondContact O-N 2.8Å; V185-R187 VanDerWaalsContact C-N 3.35Å; V185-R187 PolarHBondContact O-N 2.72Å; V185-R188 WeakPolarHBondContact O-CB 3.25Å; V185-R188 PolarHBondContact O-N 2.82Å; V185-R188 VanDerWaalsContact O-N 3.1Å; V185-N189 VanDerWaalsContact O-CG 3.31Å; V185-N189 PolarHBondContact O-N 3.32Å; V185-N189 PolarHBondContact O-OD1 2.7Å
186	E	94.9	Very high	93.7	Very high	98 Å²	98	98.9 Å²	98.9	46%	0.458	44%	0.439	S	S	.	.	H	α-helix	trans	-55.2	-50	174.9	-71.7	172.4	161.7	0	0	110.7	I182 R188 N189 E190	I182-E186 HydrophobicContact CG2-CG 4.15Å; I182-E186 WeakPolarHBondContact CG2-OE1 3.48Å; I182-E186 WeakPolarHBondContact O-CG 3.46Å; I182-E186 PolarHBondContact O-N 3.19Å; E186-R188 VanDerWaalsContact C-N 3.29Å; E186-R188 PolarHBondContact O-N 3.25Å; E186-N189 PolarHBondContact O-N 2.73Å; E186-N189 VanDerWaalsContact O-N 3.09Å; E186-E190 WeakPolarHBondContact O-CG 3.21Å; E186-E190 PolarHBondContact O-N 3.22Å
187	R	92	Very high	93.2	Very high	148 Å²	148	97.5 Å²	97.5	56%	0.558	43%	0.432	S	S	*	.	H	α-helix	trans	-59.4	-36.7	176.4	-173.5	171.9	-175.9	175.4	1.8	113.1	R183 V185 I191	R183-R187 VanDerWaalsContact O-CB 3.25Å; R183-R187 WeakPolarHBondContact O-CB 3.27Å; R183-R187 PolarHBondContact O-N 3.11Å; V185-R187 VanDerWaalsContact C-N 3.35Å; V185-R187 PolarHBondContact O-N 2.72Å; R187-I191 HydrophobicContact CG-CD1 4.14Å; R187-I191 WeakPolarHBondContact O-CB 3.34Å; R187-I191 WeakPolarHBondContact O-CD1 3.48Å; R187-I191 VanDerWaalsContact O-CG1 3.23Å; R187-I191 WeakPolarHBondContact O-CG1 3.38Å; R187-I191 PolarHBondContact O-N 3.38Å; R187-I191 VanDerWaalsContact O-N 3.11Å
188	R	92.2	Very high	92.6	Very high	185 Å²	185	96.2 Å²	96.2	70%	0.698	43%	0.427	S	S	*	.	H	α-helix	trans	-67.3	-43.7	175.5	-176.8	-171.8	-65.4	-176.8	-1.9	111	K184 V185 E186 I191 E192	K184-R188 PolarHBondContact O-N 3.29Å; K184-R188 VanDerWaalsContact O-N 3.16Å; V185-R188 WeakPolarHBondContact O-CB 3.25Å; V185-R188 PolarHBondContact O-N 2.82Å; V185-R188 VanDerWaalsContact O-N 3.1Å; E186-R188 VanDerWaalsContact C-N 3.29Å; E186-R188 PolarHBondContact O-N 3.25Å; R188-I191 PolarHBondContact O-N 3.01Å; R188-E192 PolarHBondContact O-N 3.42Å
189	N	93.2	Very high	92.1	Very high	84 Å²	84	99 Å²	99	45%	0.449	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-43.4	179	-66.7	-10.3	0	0	0	110.8	V185 E186 I191 E192 E193	V185-N189 VanDerWaalsContact O-CG 3.31Å; V185-N189 PolarHBondContact O-N 3.32Å; V185-N189 PolarHBondContact O-OD1 2.7Å; E186-N189 PolarHBondContact O-N 2.73Å; E186-N189 VanDerWaalsContact O-N 3.09Å; N189-I191 PolarHBondContact O-N 3.1Å; N189-E192 PolarHBondContact O-N 3.06Å; N189-E193 WeakPolarHBondContact O-CB 3.17Å; N189-E193 WeakPolarHBondContact O-CG 3.31Å; N189-E193 PolarHBondContact O-N 2.96Å
190	E	90.2	Very high	91.7	Very high	87 Å²	87	104.3 Å²	104.3	41%	0.407	46%	0.458	S	S	.	.	H	α-helix	trans	-57.4	-46	174.2	-72.8	171.4	-179.6	0	0	112	E186 E192 E193 D194	E186-E190 WeakPolarHBondContact O-CG 3.21Å; E186-E190 PolarHBondContact O-N 3.22Å; E190-E192 VanDerWaalsContact C-N 3.33Å; E190-E192 PolarHBondContact O-N 3.26Å; E190-E193 PolarHBondContact O-N 3.24Å; E190-D194 WeakPolarHBondContact O-CB 3.29Å; E190-D194 PolarHBondContact O-N 2.97Å
191	I	89.6	Confident	91	Very high	45 Å²	45	102.6 Å²	102.6	23%	0.231	45%	0.452	C	S	.	.	H	α-helix	trans	-62	-40.3	176.6	-74	167.9	0	0	0	111.5	R187 R188 N189 R195 L209	R187-I191 HydrophobicContact CG-CD1 4.14Å; R187-I191 WeakPolarHBondContact O-CB 3.34Å; R187-I191 WeakPolarHBondContact O-CD1 3.48Å; R187-I191 VanDerWaalsContact O-CG1 3.23Å; R187-I191 WeakPolarHBondContact O-CG1 3.38Å; R187-I191 PolarHBondContact O-N 3.38Å; R187-I191 VanDerWaalsContact O-N 3.11Å; R188-I191 PolarHBondContact O-N 3.01Å; N189-I191 PolarHBondContact O-N 3.1Å; I191-R195 VanDerWaalsContact O-CG 3.27Å; I191-R195 WeakPolarHBondContact O-CG 3.43Å; I191-R195 PolarHBondContact O-N 2.94Å; I191-L209 HydrophobicContact CB-CD2 4.27Å; I191-L209 HydrophobicContact CG1-CD2 4.38Å; I191-L209 HydrophobicContact CG2-CD2 3.72Å
192	E	89.8	Confident	90.3	Very high	91 Å²	91	101.9 Å²	101.9	43%	0.425	47%	0.465	S	S	.	.	H	α-helix	trans	-71.4	-41.5	179.5	-166.4	65	-168.4	0	0	111.8	R188 N189 E190 D194 R195 E196	R188-E192 PolarHBondContact O-N 3.42Å; N189-E192 PolarHBondContact O-N 3.06Å; E190-E192 VanDerWaalsContact C-N 3.33Å; E190-E192 PolarHBondContact O-N 3.26Å; E192-D194 VanDerWaalsContact C-N 3.33Å; E192-D194 PolarHBondContact O-N 2.83Å; E192-R195 WeakPolarHBondContact O-CB 3.42Å; E192-R195 PolarHBondContact O-N 3.02Å; E192-R195 IonicContact OE2-NH1 2.67Å; E192-E196 WeakPolarHBondContact O-CG 3.5Å; E192-E196 PolarHBondContact O-N 2.76Å
193	E	89.6	Confident	89.6	Confident	100 Å²	100	103.2 Å²	103.2	47%	0.467	47%	0.472	S	S	.	.	H	α-helix	trans	-58.8	-44.3	172.8	-75.3	178.1	-171.9	0	0	111.5	N189 E190 R195 E196 Q197 R206	N189-E193 WeakPolarHBondContact O-CB 3.17Å; N189-E193 WeakPolarHBondContact O-CG 3.31Å; N189-E193 PolarHBondContact O-N 2.96Å; E190-E193 PolarHBondContact O-N 3.24Å; E193-R195 VanDerWaalsContact C-N 3.33Å; E193-R195 PolarHBondContact O-N 2.77Å; E193-E196 PolarHBondContact O-N 3.36Å; E193-Q197 WeakPolarHBondContact O-CG 3.32Å; E193-Q197 PolarHBondContact O-N 3.33Å; E193-R206 IonicContact OE2-NH1 3.57Å
194	D	88.1	Confident	88.9	Confident	3 Å²	3	97 Å²	97	2%	0.016	45%	0.452	C	S	.	.	H	α-helix	trans	-66.3	-35.6	177.8	-78.7	3.5	0	0	0	111.7	E190 E192 Q197 L198 R206 T208 L209	E190-D194 WeakPolarHBondContact O-CB 3.29Å; E190-D194 PolarHBondContact O-N 2.97Å; E192-D194 VanDerWaalsContact C-N 3.33Å; E192-D194 PolarHBondContact O-N 2.83Å; D194-Q197 PolarHBondContact O-N 2.87Å; D194-L198 WeakPolarHBondContact O-CG 3.17Å; D194-L198 PolarHBondContact O-N 3.06Å; D194-R206 WeakPolarHBondContact OD1-CD 3.19Å; D194-R206 WeakPolarHBondContact OD2-CB 3.26Å; D194-T208 WeakPolarHBondContact OD2-CB 3.39Å; D194-T208 VanDerWaalsContact OD2-CG2 3.3Å; D194-T208 WeakPolarHBondContact OD2-CG2 3.38Å; D194-T208 PolarHBondContact OD2-OG1 3.09Å; D194-L209 HydrophobicContact CB-CD1 4.23Å; D194-L209 HydrophobicContact CB-CD2 4.43Å; D194-L209 HydrophobicContact CB-CG 4.18Å
195	R	87.8	Confident	88.2	Confident	138 Å²	138	99.1 Å²	99.1	52%	0.521	46%	0.456	S	S	.	.	H	α-helix	trans	-64.7	-41.8	172.3	-75.7	169.5	175	-173.6	-2.5	112.6	I191 E192 E193 Q197 L198 L209	I191-R195 VanDerWaalsContact O-CG 3.27Å; I191-R195 WeakPolarHBondContact O-CG 3.43Å; I191-R195 PolarHBondContact O-N 2.94Å; E192-R195 WeakPolarHBondContact O-CB 3.42Å; E192-R195 PolarHBondContact O-N 3.02Å; E192-R195 IonicContact OE2-NH1 2.67Å; E193-R195 VanDerWaalsContact C-N 3.33Å; E193-R195 PolarHBondContact O-N 2.77Å; R195-Q197 VanDerWaalsContact C-N 3.35Å; R195-L198 PolarHBondContact O-N 3.25Å; R195-L209 HydrophobicContact CG-CD2 4.15Å
196	E	88.9	Confident	87.5	Confident	81 Å²	81	102.8 Å²	102.8	38%	0.379	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-40	175.1	-72.2	-59.4	135.9	0	0	111.4	E192 E193 L198 K199 F200	E192-E196 WeakPolarHBondContact O-CG 3.5Å; E192-E196 PolarHBondContact O-N 2.76Å; E193-E196 PolarHBondContact O-N 3.36Å; E196-L198 PolarHBondContact O-N 3.09Å; E196-K199 WeakPolarHBondContact O-CB 3.2Å; E196-K199 PolarHBondContact O-N 3.01Å; E196-K199 WeakPolarHBondContact OE1-CE 3.5Å; E196-K199 IonicContact OE1-NZ 2.61Å; E196-K199 PolarHBondContact OE1-NZ 2.94Å; E196-K199 WeakPolarHBondContact OE2-CE 3.45Å; E196-K199 IonicContact OE2-NZ 2.72Å; E196-K199 PolarHBondContact OE2-NZ 3.18Å; E196-F200 WeakPolarHBondContact O-CD2 3.47Å
197	Q	87.8	Confident	86.8	Confident	87 Å²	87	105.4 Å²	105.4	41%	0.407	48%	0.476	S	S	.	.	H	α-helix	trans	-64.7	-37.8	175.4	-72.5	175.7	21	0	0	112.6	E193 D194 R195 K199 F200 N201	E193-Q197 WeakPolarHBondContact O-CG 3.32Å; E193-Q197 PolarHBondContact O-N 3.33Å; D194-Q197 PolarHBondContact O-N 2.87Å; R195-Q197 VanDerWaalsContact C-N 3.35Å; Q197-K199 PolarHBondContact O-N 3.37Å; Q197-K199 VanDerWaalsContact O-N 3.15Å; Q197-F200 PolarHBondContact O-N 3.43Å; Q197-N201 PolarHBondContact O-N 2.86Å
198	L	86	Confident	86.3	Confident	62 Å²	62	100 Å²	100	33%	0.325	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-20.8	177.5	-78.9	179.3	0	0	0	113.7	D194 R195 E196 F200 N201 N204 L209	D194-L198 WeakPolarHBondContact O-CG 3.17Å; D194-L198 PolarHBondContact O-N 3.06Å; R195-L198 PolarHBondContact O-N 3.25Å; E196-L198 PolarHBondContact O-N 3.09Å; L198-F200 PolarHBondContact O-N 3.13Å; L198-N201 VanDerWaalsContact CA-O 3.31Å; L198-N201 WeakPolarHBondContact CA-O 3.41Å; L198-N201 WeakPolarHBondContact CD2-O 3.11Å; L198-N204 HydrophobicContact CD2-CB 4.34Å; L198-L209 HydrophobicContact CD1-CD1 3.33Å; L198-L209 HydrophobicContact CG-CD1 4.35Å
199	K	87.2	Confident	85.5	Confident	137 Å²	137	94 Å²	94	60%	0.596	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-26.9	172.5	-61.1	179.6	-175.9	169.7	0	112.6	E196 Q197	E196-K199 WeakPolarHBondContact O-CB 3.2Å; E196-K199 PolarHBondContact O-N 3.01Å; E196-K199 WeakPolarHBondContact OE1-CE 3.5Å; E196-K199 IonicContact OE1-NZ 2.61Å; E196-K199 PolarHBondContact OE1-NZ 2.94Å; E196-K199 WeakPolarHBondContact OE2-CE 3.45Å; E196-K199 IonicContact OE2-NZ 2.72Å; E196-K199 PolarHBondContact OE2-NZ 3.18Å; Q197-K199 PolarHBondContact O-N 3.37Å; Q197-K199 VanDerWaalsContact O-N 3.15Å
200	F	88.1	Confident	84.3	Confident	185 Å²	185	98.2 Å²	98.2	81%	0.811	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-27.6	-177.3	-56.6	-74.7	0	0	0	113.2	E196 Q197 L198	E196-F200 WeakPolarHBondContact O-CD2 3.47Å; Q197-F200 PolarHBondContact O-N 3.43Å; L198-F200 PolarHBondContact O-N 3.13Å
201	N	83.4	Confident	84	Confident	63 Å²	63	98.8 Å²	98.8	34%	0.337	47%	0.473	S	S	.	.			trans	-135.8	119.6	-179.4	-171.4	-17.6	0	0	0	110.5	Q197 L198 I203 W205	Q197-N201 PolarHBondContact O-N 2.86Å; L198-N201 VanDerWaalsContact CA-O 3.31Å; L198-N201 WeakPolarHBondContact CA-O 3.41Å; L198-N201 WeakPolarHBondContact CD2-O 3.11Å; N201-I203 PolarHBondContact O-N 2.72Å; N201-I203 VanDerWaalsContact O-N 3.07Å; N201-I203 PolarHBondContact OD1-N 3.15Å; N201-W205 PolarHBondContact ND2-NE1 3.17Å
202	P	82.1	Confident	83.7	Confident	118 Å²	118	101.6 Å²	101.6	77%	0.766	49%	0.486	S	S	*	.	S	Bend	trans	-69.6	-6.1	-174.7	28.5	-36	0	0	0	115
203	I	81.3	Confident	83.3	Confident	89 Å²	89	102.2 Å²	102.2	46%	0.456	49%	0.489	S	S	.	.			trans	-98	121.8	-177.5	-58.4	173	0	0	0	110.3	N201 W205	N201-I203 PolarHBondContact O-N 2.72Å; N201-I203 VanDerWaalsContact O-N 3.07Å; N201-I203 PolarHBondContact OD1-N 3.15Å; I203-W205 HydrophobicContact CB-CD2 4.43Å; I203-W205 HydrophobicContact CB-CZ2 4.11Å; I203-W205 HydrophobicContact CD1-CH2 4.15Å; I203-W205 HydrophobicContact CD1-CZ2 3.76Å; I203-W205 HydrophobicContact CG2-CD2 3.8Å; I203-W205 HydrophobicContact CG2-CE3 4.17Å; I203-W205 HydrophobicContact CG2-CG 4.21Å; I203-W205 HydrophobicContact CG2-CH2 4.35Å; I203-W205 HydrophobicContact CG2-CZ2 3.99Å; I203-W205 HydrophobicContact CG2-CZ3 4.43Å; I203-W205 PolarHBondContact O-N 2.97Å
204	N	82	Confident	83	Confident	45 Å²	45	102.4 Å²	102.4	24%	0.241	49%	0.49	C	S	.	.			trans	-77.1	82.4	170.2	177.4	10.4	0	0	0	110.6	L198 R206 Q207 L209	L198-N204 HydrophobicContact CD2-CB 4.34Å; N204-R206 VanDerWaalsContact C-N 3.31Å; N204-R206 PolarHBondContact O-N 3.49Å; N204-Q207 WeakPolarHBondContact ND2-CA 3.09Å; N204-Q207 PolarHBondContact O-N 3.03Å; N204-Q207 PolarHBondContact OD1-N 2.95Å; N204-L209 WeakPolarHBondContact ND2-CB 3.49Å
205	W	81.5	Confident	82.6	Confident	174 Å²	174	108.6 Å²	108.6	66%	0.659	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.6	-177.5	-63.8	98.6	0	0	0	113.9	N201 I203	N201-W205 PolarHBondContact ND2-NE1 3.17Å; I203-W205 HydrophobicContact CB-CD2 4.43Å; I203-W205 HydrophobicContact CB-CZ2 4.11Å; I203-W205 HydrophobicContact CD1-CH2 4.15Å; I203-W205 HydrophobicContact CD1-CZ2 3.76Å; I203-W205 HydrophobicContact CG2-CD2 3.8Å; I203-W205 HydrophobicContact CG2-CE3 4.17Å; I203-W205 HydrophobicContact CG2-CG 4.21Å; I203-W205 HydrophobicContact CG2-CH2 4.35Å; I203-W205 HydrophobicContact CG2-CZ2 3.99Å; I203-W205 HydrophobicContact CG2-CZ3 4.43Å; I203-W205 PolarHBondContact O-N 2.97Å
206	R	81.2	Confident	82.3	Confident	139 Å²	139	106.6 Å²	106.6	53%	0.525	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.1	-176.1	-61.5	-169.1	178	-172.5	-0.2	113.6	E193 D194 N204 T208	E193-R206 IonicContact OE2-NH1 3.57Å; D194-R206 WeakPolarHBondContact OD1-CD 3.19Å; D194-R206 WeakPolarHBondContact OD2-CB 3.26Å; N204-R206 VanDerWaalsContact C-N 3.31Å; N204-R206 PolarHBondContact O-N 3.49Å; R206-T208 HydrophobicContact CB-CG2 3.79Å; R206-T208 PolarHBondContact O-N 3.27Å; R206-T208 VanDerWaalsContact O-N 3.12Å
207	Q	81.3	Confident	81.8	Confident	153 Å²	153	108.4 Å²	108.4	72%	0.715	53%	0.53	S	S	*	.			trans	55	26.4	-180	-57.9	-175.3	-32.7	0	0	114	N204	N204-Q207 WeakPolarHBondContact ND2-CA 3.09Å; N204-Q207 PolarHBondContact O-N 3.03Å; N204-Q207 PolarHBondContact OD1-N 2.95Å
208	T	80.4	Confident	81.4	Confident	34 Å²	34	110.1 Å²	110.1	21%	0.209	54%	0.539	C	S	.	.			trans	-81.7	-24.2	-177.6	74.6	0	0	0	0	113.1	D194 R206 T210	D194-T208 WeakPolarHBondContact OD2-CB 3.39Å; D194-T208 VanDerWaalsContact OD2-CG2 3.3Å; D194-T208 WeakPolarHBondContact OD2-CG2 3.38Å; D194-T208 PolarHBondContact OD2-OG1 3.09Å; R206-T208 HydrophobicContact CB-CG2 3.79Å; R206-T208 PolarHBondContact O-N 3.27Å; R206-T208 VanDerWaalsContact O-N 3.12Å; T208-T210 VanDerWaalsContact C-N 3.28Å; T208-T210 PolarHBondContact O-N 3.42Å
209	L	76.2	Confident	81	Confident	58 Å²	58	114.1 Å²	114.1	30%	0.304	56%	0.557	S	S	.	*			trans	-77.7	75.9	173.5	-52.2	171	0	0	0	110.2	I191 D194 R195 L198 N204	I191-L209 HydrophobicContact CB-CD2 4.27Å; I191-L209 HydrophobicContact CG1-CD2 4.38Å; I191-L209 HydrophobicContact CG2-CD2 3.72Å; D194-L209 HydrophobicContact CB-CD1 4.23Å; D194-L209 HydrophobicContact CB-CD2 4.43Å; D194-L209 HydrophobicContact CB-CG 4.18Å; R195-L209 HydrophobicContact CG-CD2 4.15Å; L198-L209 HydrophobicContact CD1-CD1 3.33Å; L198-L209 HydrophobicContact CG-CD1 4.35Å; N204-L209 WeakPolarHBondContact ND2-CB 3.49Å
210	T	67.1	Low	80.4	Confident	174 Å²	174	112 Å²	112	100%	1.067	55%	0.554	S	S	*	*			trans	-111.7	0	166	57.1	0	0	0	0	110.7	T208	T208-T210 VanDerWaalsContact C-N 3.28Å; T208-T210 PolarHBondContact O-N 3.42Å

Retrieved 210 of 210 residues in 333.5 ms (Link to these results)

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